Diff of the two buildlogs: -- --- b1/build.log 2025-01-21 03:05:40.664096560 +0000 +++ b2/build.log 2025-01-21 03:07:41.458663072 +0000 @@ -1,6 +1,6 @@ I: pbuilder: network access will be disabled during build -I: Current time: Mon Jan 20 15:02:10 -12 2025 -I: pbuilder-time-stamp: 1737428530 +I: Current time: Mon Feb 23 23:28:43 +14 2026 +I: pbuilder-time-stamp: 1771838923 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/unstable-reproducible-base.tgz] I: copying local configuration @@ -28,54 +28,86 @@ dpkg-source: info: applying disable_failing_tests.patch I: using fakeroot in build. I: Installing the build-deps -I: user script /srv/workspace/pbuilder/28393/tmp/hooks/D02_print_environment starting +I: user script /srv/workspace/pbuilder/94934/tmp/hooks/D01_modify_environment starting +debug: Running on ionos16-i386. +I: Changing host+domainname to test build reproducibility +I: Adding a custom variable just for the fun of it... +I: Changing /bin/sh to bash +'/bin/sh' -> '/bin/bash' +lrwxrwxrwx 1 root root 9 Feb 23 09:28 /bin/sh -> /bin/bash +I: Setting pbuilder2's login shell to /bin/bash +I: Setting pbuilder2's GECOS to second user,second room,second work-phone,second home-phone,second other +I: user script /srv/workspace/pbuilder/94934/tmp/hooks/D01_modify_environment finished +I: user script /srv/workspace/pbuilder/94934/tmp/hooks/D02_print_environment starting I: set - BUILDDIR='/build/reproducible-path' - BUILDUSERGECOS='first user,first room,first work-phone,first home-phone,first other' - BUILDUSERNAME='pbuilder1' - BUILD_ARCH='i386' - DEBIAN_FRONTEND='noninteractive' - DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=11 ' - DISTRIBUTION='unstable' - HOME='/root' - HOST_ARCH='i386' + BASH=/bin/sh + BASHOPTS=checkwinsize:cmdhist:complete_fullquote:extquote:force_fignore:globasciiranges:globskipdots:hostcomplete:interactive_comments:patsub_replacement:progcomp:promptvars:sourcepath + BASH_ALIASES=() + BASH_ARGC=() + BASH_ARGV=() + BASH_CMDS=() + BASH_LINENO=([0]="12" [1]="0") + BASH_LOADABLES_PATH=/usr/local/lib/bash:/usr/lib/bash:/opt/local/lib/bash:/usr/pkg/lib/bash:/opt/pkg/lib/bash:. + BASH_SOURCE=([0]="/tmp/hooks/D02_print_environment" [1]="/tmp/hooks/D02_print_environment") + BASH_VERSINFO=([0]="5" [1]="2" [2]="37" [3]="1" [4]="release" [5]="i686-pc-linux-gnu") + BASH_VERSION='5.2.37(1)-release' + BUILDDIR=/build/reproducible-path + BUILDUSERGECOS='second user,second room,second work-phone,second home-phone,second other' + BUILDUSERNAME=pbuilder2 + BUILD_ARCH=i386 + DEBIAN_FRONTEND=noninteractive + DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=21 ' + DIRSTACK=() + DISTRIBUTION=unstable + EUID=0 + FUNCNAME=([0]="Echo" [1]="main") + GROUPS=() + HOME=/root + HOSTNAME=i-capture-the-hostname + HOSTTYPE=i686 + HOST_ARCH=i386 IFS=' ' - INVOCATION_ID='bd29b7b59775470ab11904f28c2aede5' - LANG='C' - LANGUAGE='en_US:en' - LC_ALL='C' - LD_LIBRARY_PATH='/usr/lib/libeatmydata' - LD_PRELOAD='libeatmydata.so' - MAIL='/var/mail/root' - OPTIND='1' - PATH='/usr/sbin:/usr/bin:/sbin:/bin:/usr/games' - PBCURRENTCOMMANDLINEOPERATION='build' - PBUILDER_OPERATION='build' - PBUILDER_PKGDATADIR='/usr/share/pbuilder' - PBUILDER_PKGLIBDIR='/usr/lib/pbuilder' - PBUILDER_SYSCONFDIR='/etc' - PPID='28393' - PS1='# ' - PS2='> ' + INVOCATION_ID=4ff89289dbe4426f8c4db477069a09e3 + LANG=C + LANGUAGE=de_CH:de + LC_ALL=C + LD_LIBRARY_PATH=/usr/lib/libeatmydata + LD_PRELOAD=libeatmydata.so + MACHTYPE=i686-pc-linux-gnu + MAIL=/var/mail/root + OPTERR=1 + OPTIND=1 + OSTYPE=linux-gnu + PATH=/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path + PBCURRENTCOMMANDLINEOPERATION=build + PBUILDER_OPERATION=build + PBUILDER_PKGDATADIR=/usr/share/pbuilder + PBUILDER_PKGLIBDIR=/usr/lib/pbuilder + PBUILDER_SYSCONFDIR=/etc + PIPESTATUS=([0]="0") + POSIXLY_CORRECT=y + PPID=94934 PS4='+ ' - PWD='/' - SHELL='/bin/bash' - SHLVL='2' - SUDO_COMMAND='/usr/bin/timeout -k 18.1h 18h /usr/bin/ionice -c 3 /usr/bin/nice /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.MSXUJ4io/pbuilderrc_r7tq --distribution unstable --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/unstable-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.MSXUJ4io/b1 --logfile b1/build.log mopac_23.0.3-1.dsc' - SUDO_GID='112' - SUDO_UID='107' - SUDO_USER='jenkins' - TERM='unknown' - TZ='/usr/share/zoneinfo/Etc/GMT+12' - USER='root' - _='/usr/bin/systemd-run' - http_proxy='http://46.16.76.132:3128' + PWD=/ + SHELL=/bin/bash + SHELLOPTS=braceexpand:errexit:hashall:interactive-comments:posix + SHLVL=3 + SUDO_COMMAND='/usr/bin/timeout -k 24.1h 24h /usr/bin/ionice -c 3 /usr/bin/nice -n 11 /usr/bin/unshare --uts -- /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.MSXUJ4io/pbuilderrc_D5tP --distribution unstable --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/unstable-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.MSXUJ4io/b2 --logfile b2/build.log mopac_23.0.3-1.dsc' + SUDO_GID=112 + SUDO_UID=107 + SUDO_USER=jenkins + TERM=unknown + TZ=/usr/share/zoneinfo/Etc/GMT-14 + UID=0 + USER=root + _='I: set' + http_proxy=http://213.165.73.152:3128 I: uname -a - Linux ionos12-i386 6.1.0-30-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.124-1 (2025-01-12) x86_64 GNU/Linux + Linux i-capture-the-hostname 6.1.0-30-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.124-1 (2025-01-12) x86_64 GNU/Linux I: ls -l /bin - lrwxrwxrwx 1 root root 7 Nov 22 14:40 /bin -> usr/bin -I: user script /srv/workspace/pbuilder/28393/tmp/hooks/D02_print_environment finished + lrwxrwxrwx 1 root root 7 Nov 22 2024 /bin -> usr/bin +I: user script /srv/workspace/pbuilder/94934/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy @@ -205,7 +237,7 @@ Get: 80 http://deb.debian.org/debian unstable/main i386 liblapack3 i386 3.12.0-4 [2194 kB] Get: 81 http://deb.debian.org/debian unstable/main i386 liblapack-dev i386 3.12.0-4 [4452 kB] Get: 82 http://deb.debian.org/debian unstable/main i386 python3-numpy i386 1:1.26.4+ds-13 [4751 kB] -Fetched 74.4 MB in 1s (86.8 MB/s) +Fetched 74.4 MB in 1s (135 MB/s) Preconfiguring packages ... Selecting previously unselected package libpython3.13-minimal:i386. (Reading database ... (Reading database ... 5% (Reading database ... 10% (Reading database ... 15% (Reading database ... 20% (Reading database ... 25% (Reading database ... 30% (Reading database ... 35% (Reading database ... 40% (Reading database ... 45% (Reading database ... 50% (Reading database ... 55% (Reading database ... 60% (Reading database ... 65% (Reading database ... 70% (Reading database ... 75% (Reading database ... 80% (Reading database ... 85% (Reading database ... 90% (Reading database ... 95% (Reading database ... 100% (Reading database ... 19837 files and directories currently installed.) @@ -486,8 +518,8 @@ Setting up tzdata (2025a-1) ... Current default time zone: 'Etc/UTC' -Local time is now: Tue Jan 21 03:02:42 UTC 2025. -Universal Time is now: Tue Jan 21 03:02:42 UTC 2025. +Local time is now: Mon Feb 23 09:29:07 UTC 2026. +Universal Time is now: Mon Feb 23 09:29:07 UTC 2026. Run 'dpkg-reconfigure tzdata' if you wish to change it. Setting up autotools-dev (20220109.1) ... @@ -571,7 +603,11 @@ fakeroot is already the newest version (1.36.2-1). 0 upgraded, 0 newly installed, 0 to remove and 0 not upgraded. I: Building the package -I: Running cd /build/reproducible-path/mopac-23.0.3/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-genchanges -S > ../mopac_23.0.3-1_source.changes +I: user script /srv/workspace/pbuilder/94934/tmp/hooks/A99_set_merged_usr starting +Not re-configuring usrmerge for unstable +I: user script /srv/workspace/pbuilder/94934/tmp/hooks/A99_set_merged_usr finished +hostname: Name or service not known +I: Running cd /build/reproducible-path/mopac-23.0.3/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-genchanges -S > ../mopac_23.0.3-1_source.changes dpkg-buildpackage: info: source package mopac dpkg-buildpackage: info: source version 23.0.3-1 dpkg-buildpackage: info: source distribution unstable @@ -621,8 +657,8 @@ -- Found OpenMP_Fortran: -fopenmp (found version "4.5") -- Found OpenMP: TRUE (found version "4.5") -- Found Python3: /usr/bin/python3 (found version "3.13.1") found components: Interpreter --- Configuring done (3.8s) --- Generating done (0.2s) +-- Configuring done (3.1s) +-- Generating done (0.1s) CMake Warning: Manually-specified variables were not used by the project: @@ -633,7 +669,7 @@ -- Build files have been written to: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu dh_auto_build - cd obj-i686-linux-gnu && make -j11 VERBOSE=1 + cd obj-i686-linux-gnu && make -j21 VERBOSE=1 make[1]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/mopac-23.0.3 -B/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu//CMakeFiles/progress.marks @@ -647,187 +683,187 @@ cd /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-core.dir/DependInfo.cmake "--color=" Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-makpol.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-makpol.dir/depend.internal". Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-makpol.dir/depend.internal". -Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-core.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-core.dir/depend.internal". -Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-core.dir/depend.internal". Scanning dependencies of target mopac-makpol make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' make -f CMakeFiles/mopac-makpol.dir/build.make CMakeFiles/mopac-makpol.dir/build make[3]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' +Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-core.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-core.dir/depend.internal". +Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-core.dir/depend.internal". +[ 0%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/common_elemts.F90.o [ 0%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/common_ctvec.F90.o -[ 1%] Building Fortran object 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GNU -[ 3%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/mod_atomradii.F90.o +/usr/bin/cmake -E cmake_copy_f90_mod common_atomtx.mod CMakeFiles/mopac-makpol.dir/common_atomtx.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod common_keywrd.mod CMakeFiles/mopac-makpol.dir/common_keywrd.mod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/mopac-makpol.dir/src/makpol/common_sizes.F90.o.provides.build -/usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -c /build/reproducible-path/mopac-23.0.3/src/makpol/mod_atomradii.F90 -o CMakeFiles/mopac-makpol.dir/src/makpol/mod_atomradii.F90.o -/usr/bin/cmake -E cmake_copy_f90_mod common_elemts.mod CMakeFiles/mopac-makpol.dir/common_elemts.mod.stamp GNU -/usr/bin/cmake -E cmake_copy_f90_mod common_geosym.mod CMakeFiles/mopac-makpol.dir/common_geosym.mod.stamp GNU +/usr/bin/cmake -E cmake_copy_f90_mod common_systm.mod CMakeFiles/mopac-makpol.dir/common_systm.mod.stamp GNU /usr/bin/cmake 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+/usr/bin/cmake -E touch CMakeFiles/mopac-makpol.dir/src/makpol/common_systm.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod mod_atomradii.mod CMakeFiles/mopac-makpol.dir/mod_atomradii.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/mopac-makpol.dir/src/makpol/common_jobnam.F90.o.provides.build -[ 3%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/setcuc.F90.o +/usr/bin/cmake -E touch CMakeFiles/mopac-makpol.dir/src/makpol/common_keywrd.F90.o.provides.build +/usr/bin/cmake -E touch CMakeFiles/mopac-makpol.dir/src/makpol/common_titles.F90.o.provides.build +/usr/bin/cmake -E touch CMakeFiles/mopac-makpol.dir/src/makpol/mod_atomradii.F90.o.provides.build +[ 3%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/symtry.F90.o +[ 3%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/haddon.F90.o +[ 3%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/maksym.F90.o +[ 4%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/getsym.F90.o +/usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -c /build/reproducible-path/mopac-23.0.3/src/makpol/symtry.F90 -o CMakeFiles/mopac-makpol.dir/src/makpol/symtry.F90.o +/usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -c /build/reproducible-path/mopac-23.0.3/src/makpol/haddon.F90 -o CMakeFiles/mopac-makpol.dir/src/makpol/haddon.F90.o +/usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -c /build/reproducible-path/mopac-23.0.3/src/makpol/getsym.F90 -o CMakeFiles/mopac-makpol.dir/src/makpol/getsym.F90.o +/usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -c /build/reproducible-path/mopac-23.0.3/src/makpol/maksym.F90 -o CMakeFiles/mopac-makpol.dir/src/makpol/maksym.F90.o +[ 4%] Building Fortran object 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8%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/iter_C.F90.o +[ 8%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/Param_global_C.F90.o +[ 8%] Building Fortran object CMakeFiles/mopac-core.dir/src/chanel_C.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/MOZYME_C.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/MOZYME_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/Common_arrays_C.F90 -o CMakeFiles/mopac-core.dir/src/Common_arrays_C.F90.o +[ 8%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/atomradii_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 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-DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/to_screen_C.F90 -o CMakeFiles/mopac-core.dir/src/output/to_screen_C.F90.o -[ 9%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/haddon.F90.o -[ 9%] Building Fortran object CMakeFiles/mopac-core.dir/src/solvation/cosmo_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/solvation/cosmo_C.F90 -o CMakeFiles/mopac-core.dir/src/solvation/cosmo_C.F90.o -[ 9%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/maksym.F90.o -/usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -c /build/reproducible-path/mopac-23.0.3/src/makpol/haddon.F90 -o 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CMakeFiles/mopac-core.dir/src/symmetry/symmetry_C.F90.o -[ 9%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/journal_references_C.F90.o -[ 9%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_AM1_C.F90.o +[ 11%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_AM1_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/journal_references_C.F90 -o CMakeFiles/mopac-core.dir/src/models/journal_references_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_AM1_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_AM1_C.F90.o -/usr/bin/cmake -E cmake_copy_f90_mod common_ctvec.mod CMakeFiles/mopac-makpol.dir/common_ctvec.mod.stamp GNU -[ 9%] Building Fortran object CMakeFiles/mopac-makpol.dir/src/makpol/symtry.F90.o -/usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -c /build/reproducible-path/mopac-23.0.3/src/makpol/symtry.F90 -o CMakeFiles/mopac-makpol.dir/src/makpol/symtry.F90.o -[ 9%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_AM1_Sparkles_C.F90.o -/usr/bin/cmake -E touch CMakeFiles/mopac-makpol.dir/src/makpol/common_systm.F90.o.provides.build +[ 11%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_AM1_Sparkles_C.F90.o +[ 11%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_INDO_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c 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-fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_mndo_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_mndo_C.F90.o [ 12%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_mndod_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_mndod_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_mndod_C.F90.o [ 13%] Building Fortran object CMakeFiles/mopac-core.dir/src/molmec_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/molmec_C.F90 -o CMakeFiles/mopac-core.dir/src/molmec_C.F90.o [ 13%] Building Fortran object CMakeFiles/mopac-core.dir/src/optimization/ef_C.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/ef_C.F90 -o CMakeFiles/mopac-core.dir/src/optimization/ef_C.F90.o [ 13%] Building Fortran object CMakeFiles/mopac-core.dir/src/overlaps_C.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/ef_C.F90 -o CMakeFiles/mopac-core.dir/src/optimization/ef_C.F90.o +[ 13%] Building Fortran object CMakeFiles/mopac-core.dir/src/potentials/rotate_C.F90.o [ 13%] Building Fortran object CMakeFiles/mopac-core.dir/src/potentials/esp_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 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-DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/potentials/rotate_C.F90 -o CMakeFiles/mopac-core.dir/src/potentials/rotate_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/properties/polar_C.F90 -o CMakeFiles/mopac-core.dir/src/properties/polar_C.F90.o [ 14%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/compct.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/compct.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/compct.F90.o [ 14%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/kab_for_MOZYME.F90.o -[ 14%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/local2.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/kab_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/kab_for_MOZYME.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/local2.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/local2.F90.o +[ 14%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/local2.F90.o [ 14%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/epseta.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/epseta.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/epseta.F90.o [ 14%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/fock1_for_MOZYME.F90.o -[ 15%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/jab_for_MOZYME.F90.o +[ 15%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/fock1.F90.o +[ 15%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/copyc6.F90.o +[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/jab_for_MOZYME.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/local2.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/local2.F90.o +[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/forces/deri0.F90.o +[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/forces/xyzcry.F90.o +[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/forces/deri21.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/epseta.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/epseta.F90.o +[ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/dang.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/fock1_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/fock1_for_MOZYME.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/jab_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/jab_for_MOZYME.F90.o -[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/fock1.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/SCF/fock1.F90 -o CMakeFiles/mopac-core.dir/src/SCF/fock1.F90.o -[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/copyc6.F90.o +[ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/volume.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/copyc6.F90 -o CMakeFiles/mopac-core.dir/src/corrections/copyc6.F90.o -[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/forces/xyzcry.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/forces/xyzcry.F90 -o CMakeFiles/mopac-core.dir/src/forces/xyzcry.F90.o -[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/forces/deri0.F90.o -[ 16%] Building Fortran object CMakeFiles/mopac-core.dir/src/forces/deri21.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/forces/deri0.F90 -o CMakeFiles/mopac-core.dir/src/forces/deri0.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/forces/deri21.F90 -o CMakeFiles/mopac-core.dir/src/forces/deri21.F90.o -[ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/dang.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/dang.F90 -o CMakeFiles/mopac-core.dir/src/geometry/dang.F90.o -[ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/volume.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/volume.F90 -o CMakeFiles/mopac-core.dir/src/geometry/volume.F90.o [ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/cross.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/cross.F90 -o CMakeFiles/mopac-core.dir/src/geometry/cross.F90.o [ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/digit.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/cross.F90 -o CMakeFiles/mopac-core.dir/src/geometry/cross.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/digit.F90 -o CMakeFiles/mopac-core.dir/src/input/digit.F90.o [ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/nuchar.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/nuchar.F90 -o CMakeFiles/mopac-core.dir/src/input/nuchar.F90.o @@ -835,55 +871,55 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/myword.F90 -o CMakeFiles/mopac-core.dir/src/input/myword.F90.o [ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/getval.F90.o [ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/integrals/kab.F90.o +[ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/integrals/jab.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/getval.F90 -o CMakeFiles/mopac-core.dir/src/input/getval.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/integrals/kab.F90 -o CMakeFiles/mopac-core.dir/src/integrals/kab.F90.o -[ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/integrals/jab.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/integrals/jab.F90 -o CMakeFiles/mopac-core.dir/src/integrals/jab.F90.o [ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/integrals/helect.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/integrals/jab.F90 -o CMakeFiles/mopac-core.dir/src/integrals/jab.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/integrals/helect.F90 -o CMakeFiles/mopac-core.dir/src/integrals/helect.F90.o -[ 17%] Building Fortran object CMakeFiles/mopac-core.dir/src/integrals/coe.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/integrals/coe.F90 -o CMakeFiles/mopac-core.dir/src/integrals/coe.F90.o +[ 18%] Building Fortran object CMakeFiles/mopac-core.dir/src/integrals/coe.F90.o [ 18%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/schmib.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/integrals/coe.F90 -o CMakeFiles/mopac-core.dir/src/integrals/coe.F90.o [ 18%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/linpack.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/schmib.F90 -o CMakeFiles/mopac-core.dir/src/matrix/schmib.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/linpack.F90 -o CMakeFiles/mopac-core.dir/src/matrix/linpack.F90.o [ 18%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/densit.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/densit.F90 -o CMakeFiles/mopac-core.dir/src/matrix/densit.F90.o [ 18%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/density_for_GPU.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/density_for_GPU.F90 -o CMakeFiles/mopac-core.dir/src/matrix/density_for_GPU.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/linpack.F90 -o CMakeFiles/mopac-core.dir/src/matrix/linpack.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/densit.F90 -o CMakeFiles/mopac-core.dir/src/matrix/densit.F90.o [ 19%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mtxmc.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mtxmc.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mtxmc.F90.o [ 19%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mxmt.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/density_for_GPU.F90 -o CMakeFiles/mopac-core.dir/src/matrix/density_for_GPU.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mtxmc.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mtxmc.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mxmt.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mxmt.F90.o [ 19%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mat33.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mat33.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mat33.F90.o [ 20%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mxv.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mxv.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mxv.F90.o [ 20%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/diag_for_GPU.F90.o -[ 20%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mult_symm_AB.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/diag_for_GPU.F90 -o CMakeFiles/mopac-core.dir/src/matrix/diag_for_GPU.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mult_symm_AB.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mult_symm_AB.F90.o [ 21%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mtxm.F90.o +[ 21%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mult_symm_AB.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mtxm.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mtxm.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mult_symm_AB.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mult_symm_AB.F90.o [ 21%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/supdot.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/supdot.F90 -o CMakeFiles/mopac-core.dir/src/matrix/supdot.F90.o [ 21%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/schmit.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/schmit.F90 -o CMakeFiles/mopac-core.dir/src/matrix/schmit.F90.o [ 22%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mxm.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mxm.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mxm.F90.o [ 22%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/rsp.F90.o +[ 23%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/dot.F90.o +[ 23%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mult.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mxm.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mxm.F90.o +[ 23%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/minv.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/rsp.F90 -o CMakeFiles/mopac-core.dir/src/matrix/rsp.F90.o -[ 22%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mult.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mult.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mult.F90.o -[ 23%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/dot.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/dot.F90 -o CMakeFiles/mopac-core.dir/src/matrix/dot.F90.o -[ 23%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/minv.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/minv.F90 -o CMakeFiles/mopac-core.dir/src/matrix/minv.F90.o [ 23%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/mamult.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/mamult.F90 -o CMakeFiles/mopac-core.dir/src/matrix/mamult.F90.o [ 24%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/osinv.F90.o -[ 24%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/aabacd.F90.o [ 24%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/ddiag.F90.o +[ 24%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/aabacd.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/osinv.F90 -o CMakeFiles/mopac-core.dir/src/matrix/osinv.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/ddiag.F90 -o CMakeFiles/mopac-core.dir/src/matrix/ddiag.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/aabacd.F90 -o CMakeFiles/mopac-core.dir/src/meci/aabacd.F90.o @@ -892,27 +928,27 @@ [ 24%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/diagi.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/diagi.F90 -o CMakeFiles/mopac-core.dir/src/meci/diagi.F90.o [ 24%] Building Fortran object CMakeFiles/mopac-core.dir/src/optimization/exchng.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/exchng.F90 -o CMakeFiles/mopac-core.dir/src/optimization/exchng.F90.o [ 24%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/xxx.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/exchng.F90 -o CMakeFiles/mopac-core.dir/src/optimization/exchng.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/xxx.F90 -o CMakeFiles/mopac-core.dir/src/output/xxx.F90.o [ 25%] Building Fortran object CMakeFiles/mopac-core.dir/src/potentials/genun.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/potentials/genun.F90 -o CMakeFiles/mopac-core.dir/src/potentials/genun.F90.o [ 26%] Building Fortran object CMakeFiles/mopac-core.dir/src/reactions/quadr.F90.o -[ 27%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/rotmol.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/reactions/quadr.F90 -o CMakeFiles/mopac-core.dir/src/reactions/quadr.F90.o -[ 27%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/symopr.F90.o +[ 26%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/symopr.F90.o +[ 27%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/rotmol.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/symopr.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/symopr.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/rotmol.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/rotmol.F90.o [ 27%] Building Fortran object CMakeFiles/mopac-core.dir/src/utilities/prttim.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/symopr.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/symopr.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/utilities/prttim.F90 -o CMakeFiles/mopac-core.dir/src/utilities/prttim.F90.o -[ 28%] Building Fortran object CMakeFiles/mopac-core.dir/src/utilities/upcase.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/utilities/upcase.F90 -o CMakeFiles/mopac-core.dir/src/utilities/upcase.F90.o -[ 28%] Building Fortran object CMakeFiles/mopac-core.dir/src/utilities/reada.F90.o /usr/bin/cmake -E cmake_copy_f90_mod common_arrays_c.mod CMakeFiles/mopac-core.dir/common_arrays_c.mod.stamp GNU -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/utilities/reada.F90 -o CMakeFiles/mopac-core.dir/src/utilities/reada.F90.o /usr/bin/cmake -E cmake_copy_f90_mod reimers_c.mod CMakeFiles/mopac-core.dir/reimers_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod mozyme_c.mod CMakeFiles/mopac-core.dir/mozyme_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod param_global_c.mod CMakeFiles/mopac-core.dir/param_global_c.mod.stamp GNU +[ 28%] Building Fortran object CMakeFiles/mopac-core.dir/src/utilities/reada.F90.o +[ 28%] Building Fortran object CMakeFiles/mopac-core.dir/src/utilities/upcase.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/utilities/upcase.F90 -o CMakeFiles/mopac-core.dir/src/utilities/upcase.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/utilities/reada.F90 -o CMakeFiles/mopac-core.dir/src/utilities/reada.F90.o /usr/bin/cmake -E cmake_copy_f90_mod iter_c.mod CMakeFiles/mopac-core.dir/iter_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod chanel_c.mod CMakeFiles/mopac-core.dir/chanel_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod atomradii_c.mod CMakeFiles/mopac-core.dir/atomradii_c.mod.stamp GNU @@ -936,20 +972,20 @@ /usr/bin/cmake -E cmake_copy_f90_mod parameters_for_pm3_sparkles_c.mod CMakeFiles/mopac-core.dir/parameters_for_pm3_sparkles_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod parameters_for_pm6_sparkles_c.mod CMakeFiles/mopac-core.dir/parameters_for_pm6_sparkles_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod parameters_for_pm7_sparkles_c.mod CMakeFiles/mopac-core.dir/parameters_for_pm7_sparkles_c.mod.stamp GNU -[ 28%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_C.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_PM6_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_C.F90.o -[ 28%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_ORG_C.F90.o -[ 29%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_PM7_C.F90.o /usr/bin/cmake -E cmake_copy_f90_mod parameters_for_rm1_c.mod CMakeFiles/mopac-core.dir/parameters_for_rm1_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod parameters_for_rm1_sparkles_c.mod CMakeFiles/mopac-core.dir/parameters_for_rm1_sparkles_c.mod.stamp GNU -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_PM6_ORG_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_ORG_C.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_PM7_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_PM7_C.F90.o /usr/bin/cmake -E cmake_copy_f90_mod parameters_for_mndo_c.mod CMakeFiles/mopac-core.dir/parameters_for_mndo_c.mod.stamp GNU +/usr/bin/cmake -E cmake_copy_f90_mod parameters_for_mndod_c.mod CMakeFiles/mopac-core.dir/parameters_for_mndod_c.mod.stamp GNU +[ 28%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_C.F90.o +[ 29%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_PM7_C.F90.o [ 29%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_PM7_TS_C.F90.o +[ 29%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_ORG_C.F90.o [ 29%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/parameters_for_PM8_C.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_PM6_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_C.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_PM6_ORG_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_ORG_C.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_PM7_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_PM7_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_PM7_TS_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_PM7_TS_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/parameters_for_PM8_C.F90 -o CMakeFiles/mopac-core.dir/src/models/parameters_for_PM8_C.F90.o -/usr/bin/cmake -E cmake_copy_f90_mod parameters_for_mndod_c.mod CMakeFiles/mopac-core.dir/parameters_for_mndod_c.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/molkst_C.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod molmec_c.mod CMakeFiles/mopac-core.dir/molmec_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod derivs_c.mod CMakeFiles/mopac-core.dir/derivs_c.mod.stamp GNU @@ -961,32 +997,27 @@ /usr/bin/cmake -E cmake_copy_f90_mod rotate_c.mod CMakeFiles/mopac-core.dir/rotate_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod polar_c.mod CMakeFiles/mopac-core.dir/polar_c.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/reactions/maps_C.F90.o.provides.build +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/solvation/cosmo_C.F90.o.provides.build [ 30%] Building Fortran object CMakeFiles/mopac-core.dir/src/properties/CPE_Energy.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/properties/CPE_Energy.F90 -o CMakeFiles/mopac-core.dir/src/properties/CPE_Energy.F90.o -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/solvation/cosmo_C.F90.o.provides.build +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/symmetry/symmetry_C.F90.o.provides.build [ 30%] Building Fortran object CMakeFiles/mopac-core.dir/src/solvation/afmm_C.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/solvation/afmm_C.F90 -o CMakeFiles/mopac-core.dir/src/solvation/afmm_C.F90.o [ 30%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/charst.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/charst.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/charst.F90.o -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/symmetry/symmetry_C.F90.o.provides.build [ 30%] Building Fortran object CMakeFiles/mopac-core.dir/src/run_mopac.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/run_mopac.F90 -o CMakeFiles/mopac-core.dir/src/run_mopac.F90.o [ 30%] Building Fortran object CMakeFiles/mopac-core.dir/src/setup_mopac_arrays.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/setup_mopac_arrays.F90 -o CMakeFiles/mopac-core.dir/src/setup_mopac_arrays.F90.o [ 30%] Building Fortran object CMakeFiles/mopac-core.dir/src/run_param.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/charst.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/charst.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/run_mopac.F90 -o CMakeFiles/mopac-core.dir/src/run_mopac.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/setup_mopac_arrays.F90 -o CMakeFiles/mopac-core.dir/src/setup_mopac_arrays.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/run_param.F90 -o CMakeFiles/mopac-core.dir/src/run_param.F90.o -[ 30%] Linking Fortran executable mopac-makpol -/usr/bin/cmake -E cmake_link_script CMakeFiles/mopac-makpol.dir/link.txt --verbose=1 -/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/mopac-makpol.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong "CMakeFiles/mopac-makpol.dir/src/makpol/cell.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_atomtx.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_ctvec.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_elemts.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_geosym.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_jobnam.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_keywrd.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_sizes.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_symult.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_systm.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_titles.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/geout.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/getpdb.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/getsym.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/gettxt.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/haddon.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/maklay.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/makpol.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/maksym.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/mod_atomradii.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/setcuc.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/standard.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/symtry.F90.o" -o mopac-makpol -Wl,-rpath,:::::::::::::: -make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -[ 30%] Built target mopac-makpol [ 31%] Building Fortran object CMakeFiles/mopac-core.dir/src/mopend.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/mopend.F90 -o CMakeFiles/mopac-core.dir/src/mopend.F90.o [ 31%] Building Fortran object CMakeFiles/mopac-core.dir/src/moldat.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/moldat.F90 -o CMakeFiles/mopac-core.dir/src/moldat.F90.o [ 32%] Building Fortran object CMakeFiles/mopac-core.dir/src/INDO/excite.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/INDO/excite.F90 -o CMakeFiles/mopac-core.dir/src/INDO/excite.F90.o [ 32%] Building Fortran object CMakeFiles/mopac-core.dir/src/INDO/integral.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/moldat.F90 -o CMakeFiles/mopac-core.dir/src/moldat.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/INDO/excite.F90 -o CMakeFiles/mopac-core.dir/src/INDO/excite.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/INDO/integral.F90 -o CMakeFiles/mopac-core.dir/src/INDO/integral.F90.o [ 32%] Building Fortran object CMakeFiles/mopac-core.dir/src/INDO/rci.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/INDO/rci.F90 -o CMakeFiles/mopac-core.dir/src/INDO/rci.F90.o @@ -1033,8 +1064,8 @@ [ 36%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/cnvgz.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/cnvgz.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/cnvgz.F90.o [ 36%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/diagg.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/diagg.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/diagg.F90.o [ 37%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/bonds_for_MOZYME.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/diagg.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/diagg.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/bonds_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/bonds_for_MOZYME.F90.o [ 37%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/prtlmo.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/prtlmo.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/prtlmo.F90.o @@ -1046,21 +1077,26 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/dipole_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/dipole_for_MOZYME.F90.o [ 38%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/local_for_MOZYME.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/local_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/local_for_MOZYME.F90.o +[ 38%] Linking Fortran executable mopac-makpol +/usr/bin/cmake -E cmake_link_script CMakeFiles/mopac-makpol.dir/link.txt --verbose=1 [ 39%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/helecz.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/helecz.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/helecz.F90.o [ 39%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/scfcri.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/scfcri.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/scfcri.F90.o [ 39%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/pinout.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/pinout.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/pinout.F90.o +/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/mopac-makpol.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong "CMakeFiles/mopac-makpol.dir/src/makpol/cell.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_atomtx.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_ctvec.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_elemts.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_geosym.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_jobnam.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_keywrd.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_sizes.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_symult.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_systm.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/common_titles.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/geout.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/getpdb.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/getsym.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/gettxt.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/haddon.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/maklay.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/makpol.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/maksym.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/mod_atomradii.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/setcuc.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/standard.F90.o" "CMakeFiles/mopac-makpol.dir/src/makpol/symtry.F90.o" -o mopac-makpol -Wl,-rpath,:::::::::::::: +make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' [ 39%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/denrot_for_MOZYME.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/denrot_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/denrot_for_MOZYME.F90.o -[ 39%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/hybrid.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/hybrid.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/hybrid.F90.o +[ 39%] Built target mopac-makpol [ 39%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/tidy.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/tidy.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/tidy.F90.o [ 40%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/makvec.F90.o +[ 40%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/hybrid.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/makvec.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/makvec.F90.o [ 40%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/selmos.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/hybrid.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/hybrid.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/selmos.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/selmos.F90.o [ 40%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/diagg2.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/diagg2.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/diagg2.F90.o @@ -1085,8 +1121,8 @@ [ 43%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/pardip.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/pardip.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/pardip.F90.o [ 43%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/psort.F90.o -[ 43%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/rapid0.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/psort.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/psort.F90.o +[ 43%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/rapid0.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/rapid0.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/rapid0.F90.o [ 43%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/rapid1.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/rapid1.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/rapid1.F90.o @@ -1095,8 +1131,8 @@ [ 44%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/resetp.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/resetp.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/resetp.F90.o [ 44%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/getmol.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/getmol.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/getmol.F90.o [ 44%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/datinp.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/getmol.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/getmol.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/datinp.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/datinp.F90.o [ 45%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/direct.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/direct.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/direct.F90.o @@ -1104,10 +1140,10 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/parkey.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/parkey.F90.o [ 45%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/rapid2.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/rapid2.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/rapid2.F90.o -[ 45%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/optgeo.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/optgeo.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/optgeo.F90.o [ 45%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/parfg.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/parfg.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/parfg.F90.o +[ 45%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/optgeo.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/optgeo.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/optgeo.F90.o [ 45%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/pparsav.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/PARAM/pparsav.F90 -o CMakeFiles/mopac-core.dir/src/PARAM/pparsav.F90.o [ 45%] Building Fortran object CMakeFiles/mopac-core.dir/src/PARAM/finish.F90.o @@ -1132,36 +1168,36 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/SCF/resolv.F90 -o CMakeFiles/mopac-core.dir/src/SCF/resolv.F90.o [ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/fock2.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/SCF/fock2.F90 -o CMakeFiles/mopac-core.dir/src/SCF/fock2.F90.o -[ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/local.F90.o [ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/swap.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/SCF/swap.F90 -o CMakeFiles/mopac-core.dir/src/SCF/swap.F90.o +[ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/local.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/SCF/local.F90 -o CMakeFiles/mopac-core.dir/src/SCF/local.F90.o +[ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/iter.F90.o [ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/capcor.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/SCF/capcor.F90 -o CMakeFiles/mopac-core.dir/src/SCF/capcor.F90.o -[ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/iter.F90.o -[ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/pulay.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/SCF/iter.F90 -o CMakeFiles/mopac-core.dir/src/SCF/iter.F90.o +[ 48%] Building Fortran object CMakeFiles/mopac-core.dir/src/SCF/pulay.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/SCF/pulay.F90 -o CMakeFiles/mopac-core.dir/src/SCF/pulay.F90.o +[ 49%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/atomrs.F90.o [ 49%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/findn1.F90.o +[ 49%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/names.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/findn1.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/findn1.F90.o -[ 49%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/atomrs.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/atomrs.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/atomrs.F90.o -[ 49%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/names.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/names.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/names.F90.o [ 50%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/reseq.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/reseq.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/reseq.F90.o [ 50%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/lewis.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/lewis.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/lewis.F90.o [ 50%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/lyse.F90.o -[ 50%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/geochk_bits_2.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/lyse.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/lyse.F90.o +[ 50%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/geochk_bits_2.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/geochk_bits_2.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/geochk_bits_2.F90.o [ 51%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/greek.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/greek.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/greek.F90.o -[ 51%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/txtype.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/txtype.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/txtype.F90.o [ 51%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/add_hydrogen_atoms.F90.o +[ 51%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/txtype.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/add_hydrogen_atoms.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/add_hydrogen_atoms.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/txtype.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/txtype.F90.o [ 51%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/chklew.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/chklew.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/chklew.F90.o [ 52%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/nxtmer.F90.o @@ -1180,10 +1216,10 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/dftd3_bits.F90 -o CMakeFiles/mopac-core.dir/src/corrections/dftd3_bits.F90.o [ 54%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/dftd3.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/dftd3.F90 -o CMakeFiles/mopac-core.dir/src/corrections/dftd3.F90.o -[ 54%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_bits.F90.o [ 54%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_EH_plus.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/H_bond_correction_bits.F90 -o CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_bits.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/H_bond_correction_EH_plus.F90 -o CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_EH_plus.F90.o +[ 54%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_bits.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/H_bond_correction_bits.F90 -o CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_bits.F90.o [ 54%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_EC_plus_ER.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/H_bond_correction_EC_plus_ER.F90 -o CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_EC_plus_ER.F90.o [ 55%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/set_up_dentate.F90.o @@ -1191,8 +1227,8 @@ [ 55%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/gdisp.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/gdisp.F90 -o CMakeFiles/mopac-core.dir/src/corrections/gdisp.F90.o [ 55%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/disp_DnX.F90.o -[ 55%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/post_scf_corrections.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/disp_DnX.F90 -o CMakeFiles/mopac-core.dir/src/corrections/disp_DnX.F90.o +[ 55%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/post_scf_corrections.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/post_scf_corrections.F90 -o CMakeFiles/mopac-core.dir/src/corrections/post_scf_corrections.F90.o [ 55%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_PM6_DH_Dispersion.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/H_bond_correction_PM6_DH_Dispersion.F90 -o CMakeFiles/mopac-core.dir/src/corrections/H_bond_correction_PM6_DH_Dispersion.F90.o @@ -1254,18 +1290,18 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/bangle.F90 -o CMakeFiles/mopac-core.dir/src/geometry/bangle.F90.o [ 63%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/symtry.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/symtry.F90 -o CMakeFiles/mopac-core.dir/src/geometry/symtry.F90.o -[ 63%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/axis.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/axis.F90 -o CMakeFiles/mopac-core.dir/src/geometry/axis.F90.o [ 63%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/dihed.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/dihed.F90 -o CMakeFiles/mopac-core.dir/src/geometry/dihed.F90.o +[ 63%] Building Fortran object CMakeFiles/mopac-core.dir/src/geometry/axis.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/geometry/axis.F90 -o CMakeFiles/mopac-core.dir/src/geometry/axis.F90.o [ 64%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/getsym.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/getsym.F90 -o CMakeFiles/mopac-core.dir/src/input/getsym.F90.o [ 64%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/readmo.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/readmo.F90 -o CMakeFiles/mopac-core.dir/src/input/readmo.F90.o [ 65%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/wrt_diffs.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/wrt_diffs.F90 -o CMakeFiles/mopac-core.dir/src/input/wrt_diffs.F90.o [ 65%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/gettxt.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/gettxt.F90 -o CMakeFiles/mopac-core.dir/src/input/gettxt.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/wrt_diffs.F90 -o CMakeFiles/mopac-core.dir/src/input/wrt_diffs.F90.o [ 65%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/getpdb.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/input/getpdb.F90 -o CMakeFiles/mopac-core.dir/src/input/getpdb.F90.o [ 65%] Building Fortran object CMakeFiles/mopac-core.dir/src/input/datin.F90.o @@ -1303,8 +1339,8 @@ [ 71%] Building Fortran object CMakeFiles/mopac-core.dir/src/integrals/solrot.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/integrals/solrot.F90 -o CMakeFiles/mopac-core.dir/src/integrals/solrot.F90.o [ 71%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/interp.F90.o -[ 71%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/eigenvectors_LAPACK.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/interp.F90 -o CMakeFiles/mopac-core.dir/src/matrix/interp.F90.o +[ 71%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/eigenvectors_LAPACK.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/eigenvectors_LAPACK.F90 -o CMakeFiles/mopac-core.dir/src/matrix/eigenvectors_LAPACK.F90.o [ 71%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/molval.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/molval.F90 -o CMakeFiles/mopac-core.dir/src/matrix/molval.F90.o @@ -1314,36 +1350,36 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/mecid.F90 -o CMakeFiles/mopac-core.dir/src/meci/mecid.F90.o [ 72%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/babbbc.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/babbbc.F90 -o CMakeFiles/mopac-core.dir/src/meci/babbbc.F90.o -[ 72%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/mecip.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/mecip.F90 -o CMakeFiles/mopac-core.dir/src/meci/mecip.F90.o [ 72%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/partxy.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/partxy.F90 -o CMakeFiles/mopac-core.dir/src/meci/partxy.F90.o +[ 72%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/mecip.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/mecip.F90 -o CMakeFiles/mopac-core.dir/src/meci/mecip.F90.o [ 73%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/aababc.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/aababc.F90 -o CMakeFiles/mopac-core.dir/src/meci/aababc.F90.o [ 73%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/aabbcd.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/aabbcd.F90 -o CMakeFiles/mopac-core.dir/src/meci/aabbcd.F90.o [ 73%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/perm.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/perm.F90 -o CMakeFiles/mopac-core.dir/src/meci/perm.F90.o -[ 73%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/meci.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/meci.F90 -o CMakeFiles/mopac-core.dir/src/meci/meci.F90.o [ 74%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/ijkl.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/ijkl.F90 -o CMakeFiles/mopac-core.dir/src/meci/ijkl.F90.o +[ 74%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/meci.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/meci.F90 -o CMakeFiles/mopac-core.dir/src/meci/meci.F90.o [ 74%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/formxy.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/formxy.F90 -o CMakeFiles/mopac-core.dir/src/meci/formxy.F90.o [ 75%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/mecih.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/mecih.F90 -o CMakeFiles/mopac-core.dir/src/meci/mecih.F90.o [ 75%] Building Fortran object CMakeFiles/mopac-core.dir/src/meci/ciosci.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/ciosci.F90 -o CMakeFiles/mopac-core.dir/src/meci/ciosci.F90.o [ 75%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_mndod.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/meci/ciosci.F90 -o CMakeFiles/mopac-core.dir/src/meci/ciosci.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/alpb_and_xfac_mndod.F90 -o CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_mndod.F90.o [ 76%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/refer.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/refer.F90 -o CMakeFiles/mopac-core.dir/src/models/refer.F90.o -[ 76%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_mndo.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/alpb_and_xfac_mndo.F90 -o CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_mndo.F90.o +[ 76%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/calpar.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/calpar.F90 -o CMakeFiles/mopac-core.dir/src/models/calpar.F90.o [ 77%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_pm3.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/alpb_and_xfac_pm3.F90 -o CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_pm3.F90.o -[ 77%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/calpar.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/calpar.F90 -o CMakeFiles/mopac-core.dir/src/models/calpar.F90.o +[ 77%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_mndo.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/alpb_and_xfac_mndo.F90 -o CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_mndo.F90.o [ 77%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_am1.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/alpb_and_xfac_am1.F90 -o CMakeFiles/mopac-core.dir/src/models/alpb_and_xfac_am1.F90.o [ 78%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/update.F90.o @@ -1358,10 +1394,10 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/locmin.F90 -o CMakeFiles/mopac-core.dir/src/optimization/locmin.F90.o [ 80%] Building Fortran object CMakeFiles/mopac-core.dir/src/optimization/parsav.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/parsav.F90 -o CMakeFiles/mopac-core.dir/src/optimization/parsav.F90.o -[ 80%] Building Fortran object CMakeFiles/mopac-core.dir/src/optimization/powsq.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/powsq.F90 -o CMakeFiles/mopac-core.dir/src/optimization/powsq.F90.o [ 80%] Building Fortran object CMakeFiles/mopac-core.dir/src/optimization/dfpsav.F90.o +[ 80%] Building Fortran object CMakeFiles/mopac-core.dir/src/optimization/powsq.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/dfpsav.F90 -o CMakeFiles/mopac-core.dir/src/optimization/dfpsav.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/powsq.F90 -o CMakeFiles/mopac-core.dir/src/optimization/powsq.F90.o [ 81%] Building Fortran object CMakeFiles/mopac-core.dir/src/optimization/lbfgs.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/optimization/lbfgs.F90 -o CMakeFiles/mopac-core.dir/src/optimization/lbfgs.F90.o [ 81%] Building Fortran object CMakeFiles/mopac-core.dir/src/optimization/ef.F90.o @@ -1372,12 +1408,12 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/matout.F90 -o CMakeFiles/mopac-core.dir/src/output/matout.F90.o [ 82%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/eigen.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/eigen.F90 -o CMakeFiles/mopac-core.dir/src/output/eigen.F90.o -[ 82%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/pdbout.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/pdbout.F90 -o CMakeFiles/mopac-core.dir/src/output/pdbout.F90.o [ 82%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/modchg.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/modchg.F90 -o CMakeFiles/mopac-core.dir/src/output/modchg.F90.o [ 83%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/to_screen.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/to_screen.F90 -o CMakeFiles/mopac-core.dir/src/output/to_screen.F90.o +[ 83%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/pdbout.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/pdbout.F90 -o CMakeFiles/mopac-core.dir/src/output/pdbout.F90.o [ 83%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/timout.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/timout.F90 -o CMakeFiles/mopac-core.dir/src/output/timout.F90.o [ 83%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/matou1.F90.o @@ -1395,8 +1431,8 @@ [ 84%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/output_rama.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/output_rama.F90 -o CMakeFiles/mopac-core.dir/src/output/output_rama.F90.o [ 84%] Building Fortran object CMakeFiles/mopac-core.dir/src/potentials/setupg.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/potentials/setupg.F90 -o CMakeFiles/mopac-core.dir/src/potentials/setupg.F90.o [ 84%] Building Fortran object CMakeFiles/mopac-core.dir/src/potentials/pmep.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/potentials/setupg.F90 -o CMakeFiles/mopac-core.dir/src/potentials/setupg.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/potentials/pmep.F90 -o CMakeFiles/mopac-core.dir/src/potentials/pmep.F90.o [ 84%] Building Fortran object CMakeFiles/mopac-core.dir/src/potentials/new_esp.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/potentials/new_esp.F90 -o CMakeFiles/mopac-core.dir/src/potentials/new_esp.F90.o @@ -1450,18 +1486,18 @@ /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/symh.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/symh.F90.o [ 90%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/symt.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/symt.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/symt.F90.o +[ 91%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/mult33.F90.o [ 91%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/bldsym.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/bldsym.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/bldsym.F90.o -[ 91%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/mult33.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/mult33.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/mult33.F90.o [ 91%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/molsym.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/molsym.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/molsym.F90.o [ 92%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/symtrz.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/symtrz.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/symtrz.F90.o -[ 92%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/sympop.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/sympop.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/sympop.F90.o [ 92%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/dtran2.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/dtran2.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/dtran2.F90.o +[ 92%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/sympop.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/sympop.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/sympop.F90.o [ 93%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/symoir.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/symmetry/symoir.F90 -o CMakeFiles/mopac-core.dir/src/symmetry/symoir.F90.o [ 93%] Building Fortran object CMakeFiles/mopac-core.dir/src/symmetry/symr.F90.o @@ -1485,28 +1521,28 @@ /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/Common_arrays_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/INDO/reimers_C.F90.o.provides.build [ 95%] Building Fortran object CMakeFiles/mopac-core.dir/src/utilities/seconds.F90.o -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/MOZYME/MOZYME_C.F90.o.provides.build /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/utilities/seconds.F90 -o CMakeFiles/mopac-core.dir/src/utilities/seconds.F90.o +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/MOZYME/MOZYME_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/PARAM/Param_global_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/SCF/iter_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/chanel_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/chemistry/atomradii_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/conref_C.F90.o.provides.build +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/elemts_C.F90.o.provides.build [ 95%] Building Fortran object CMakeFiles/mopac-core.dir/src/chemistry/orient_water.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/chemistry/orient_water.F90 -o CMakeFiles/mopac-core.dir/src/chemistry/orient_water.F90.o -[ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/H_bonds4.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/H_bonds4.F90 -o CMakeFiles/mopac-core.dir/src/corrections/H_bonds4.F90.o -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/elemts_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/funcon_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/integrals/mndod_C.F90.o.provides.build +[ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/corrections/H_bonds4.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/corrections/H_bonds4.F90 -o CMakeFiles/mopac-core.dir/src/corrections/H_bonds4.F90.o /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api.F90.o.provides.build -[ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/interface/mopac_api_createdestroy.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/interface/mopac_api_createdestroy.F90 -o CMakeFiles/mopac-core.dir/src/interface/mopac_api_createdestroy.F90.o +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/meci/meci_C.F90.o.provides.build [ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/interface/mopac_api_operations.F90.o +[ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/interface/mopac_api_createdestroy.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/interface/mopac_api_operations.F90 -o CMakeFiles/mopac-core.dir/src/interface/mopac_api_operations.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/interface/mopac_api_createdestroy.F90 -o CMakeFiles/mopac-core.dir/src/interface/mopac_api_createdestroy.F90.o [ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/matrix/esp_utilities.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/matrix/esp_utilities.F90 -o CMakeFiles/mopac-core.dir/src/matrix/esp_utilities.F90.o -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/meci/meci_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/models/journal_references_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/models/parameters_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/models/parameters_for_AM1_C.F90.o.provides.build @@ -1534,56 +1570,56 @@ /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/properties/polar_C.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod afmm_c.mod CMakeFiles/mopac-core.dir/afmm_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod get_det.mod CMakeFiles/mopac-core.dir/get_det.mod.stamp GNU -/usr/bin/cmake -E cmake_copy_f90_mod radii_c.mod CMakeFiles/mopac-core.dir/radii_c.mod.stamp GNU -/usr/bin/cmake -E cmake_copy_f90_mod mopac_api@mopac_api_createdestroy.smod CMakeFiles/mopac-core.dir/mopac_api@mopac_api_createdestroy.smod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod mopac_api@mopac_api_operations.smod CMakeFiles/mopac-core.dir/mopac_api@mopac_api_operations.smod.stamp GNU -[ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/switch.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/switch.F90 -o CMakeFiles/mopac-core.dir/src/models/switch.F90.o /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/models/parameters_for_PM6_ORG_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/models/parameters_for_PM7_C.F90.o.provides.build +[ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/models/switch.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/models/switch.F90 -o CMakeFiles/mopac-core.dir/src/models/switch.F90.o /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/models/parameters_for_PM7_TS_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/models/parameters_for_PM8_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/properties/CPE_Energy.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/solvation/afmm_C.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/symmetry/charst.F90.o.provides.build -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/corrections/H_bonds4.F90.o.provides.build +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api_operations.F90.o.provides.build [ 96%] Building Fortran object CMakeFiles/mopac-core.dir/src/solvation/linear_cosmo.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/solvation/linear_cosmo.F90 -o CMakeFiles/mopac-core.dir/src/solvation/linear_cosmo.F90.o -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api_createdestroy.F90.o.provides.build [ 97%] Building Fortran object CMakeFiles/mopac-core.dir/src/interface/mopac_api_finalize.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/interface/mopac_api_finalize.F90 -o CMakeFiles/mopac-core.dir/src/interface/mopac_api_finalize.F90.o [ 97%] Building Fortran object CMakeFiles/mopac-core.dir/src/interface/mopac_api_initialize.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/interface/mopac_api_finalize.F90 -o CMakeFiles/mopac-core.dir/src/interface/mopac_api_finalize.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/interface/mopac_api_initialize.F90 -o CMakeFiles/mopac-core.dir/src/interface/mopac_api_initialize.F90.o -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api_operations.F90.o.provides.build -/usr/bin/cmake -E cmake_copy_f90_mod saxpy_i.mod CMakeFiles/mopac-core.dir/saxpy_i.mod.stamp GNU [ 97%] Building Fortran object CMakeFiles/mopac-core.dir/src/interface/mopac_api_saveload.F90.o -/usr/bin/cmake -E cmake_copy_f90_mod scopy_i.mod CMakeFiles/mopac-core.dir/scopy_i.mod.stamp GNU /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/interface/mopac_api_saveload.F90 -o CMakeFiles/mopac-core.dir/src/interface/mopac_api_saveload.F90.o +/usr/bin/cmake -E cmake_copy_f90_mod mopac_api@mopac_api_createdestroy.smod CMakeFiles/mopac-core.dir/mopac_api@mopac_api_createdestroy.smod.stamp GNU +/usr/bin/cmake -E cmake_copy_f90_mod radii_c.mod CMakeFiles/mopac-core.dir/radii_c.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api_createdestroy.F90.o.provides.build +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/corrections/H_bonds4.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod mopac_api@mopac_api_finalize.smod CMakeFiles/mopac-core.dir/mopac_api@mopac_api_finalize.smod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/matrix/esp_utilities.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api_finalize.F90.o.provides.build -/usr/bin/cmake -E cmake_copy_f90_mod orient_water_c.mod CMakeFiles/mopac-core.dir/orient_water_c.mod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/chemistry/orient_water.F90.o.provides.build -/usr/bin/cmake -E cmake_copy_f90_mod mopac_api@mopac_api_initialize.smod CMakeFiles/mopac-core.dir/mopac_api@mopac_api_initialize.smod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api_initialize.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod mopac_api@mopac_api_saveload.smod CMakeFiles/mopac-core.dir/mopac_api@mopac_api_saveload.smod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api_saveload.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod mopac_api@mopac_api_initialize.smod CMakeFiles/mopac-core.dir/mopac_api@mopac_api_initialize.smod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/interface/mopac_api_initialize.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod saxpy_i.mod CMakeFiles/mopac-core.dir/saxpy_i.mod.stamp GNU +/usr/bin/cmake -E cmake_copy_f90_mod scopy_i.mod CMakeFiles/mopac-core.dir/scopy_i.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/matrix/esp_utilities.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod orient_water_c.mod CMakeFiles/mopac-core.dir/orient_water_c.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/chemistry/orient_water.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod cosmo_mini.mod CMakeFiles/mopac-core.dir/cosmo_mini.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod linear_cosmo.mod CMakeFiles/mopac-core.dir/linear_cosmo.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/mopac-core.dir/src/solvation/linear_cosmo.F90.o.provides.build +[ 97%] Building Fortran object CMakeFiles/mopac-core.dir/src/compfg.F90.o +[ 97%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/fock2z.F90.o [ 98%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/iter_for_MOZYME.F90.o -[ 98%] Building Fortran object CMakeFiles/mopac-core.dir/src/compfg.F90.o -[ 98%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/fock2z.F90.o -[ 98%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/writmo.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/compfg.F90 -o CMakeFiles/mopac-core.dir/src/compfg.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/iter_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/iter_for_MOZYME.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/fock2z.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/fock2z.F90.o [ 98%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/prtpka.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/iter_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/iter_for_MOZYME.F90.o [ 98%] Building Fortran object CMakeFiles/mopac-core.dir/src/MOZYME/hcore_for_MOZYME.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/fock2z.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/fock2z.F90.o -/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/writmo.F90 -o CMakeFiles/mopac-core.dir/src/output/writmo.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/prtpka.F90 -o CMakeFiles/mopac-core.dir/src/output/prtpka.F90.o +[ 98%] Building Fortran object CMakeFiles/mopac-core.dir/src/output/writmo.F90.o /usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/MOZYME/hcore_for_MOZYME.F90 -o CMakeFiles/mopac-core.dir/src/MOZYME/hcore_for_MOZYME.F90.o +/usr/bin/f95 -DMOPAC_OS=\"Linux\" -DMOPAC_VERSION_FULL=\"23.0.3\" -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/output/writmo.F90 -o CMakeFiles/mopac-core.dir/src/output/writmo.F90.o [ 98%] Linking Fortran static library libmopac.a /usr/bin/cmake -P CMakeFiles/mopac-core.dir/cmake_clean_target.cmake /usr/bin/cmake -E cmake_link_script CMakeFiles/mopac-core.dir/link.txt --verbose=1 @@ -1593,52 +1629,52 @@ [ 98%] Built target mopac-core make -f CMakeFiles/mopac.dir/build.make CMakeFiles/mopac.dir/depend make -f CMakeFiles/mopac-param.dir/build.make CMakeFiles/mopac-param.dir/depend -make -f CMakeFiles/mopac-api-test.dir/build.make CMakeFiles/mopac-api-test.dir/depend make[3]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' cd /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' cd /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-param.dir/DependInfo.cmake "--color=" +make -f CMakeFiles/mopac-api-test.dir/build.make CMakeFiles/mopac-api-test.dir/depend make[3]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' cd /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-api-test.dir/DependInfo.cmake "--color=" Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac.dir/depend.internal". -Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-api-test.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-api-test.dir/depend.internal". -Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-api-test.dir/depend.internal". Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac.dir/depend.internal". +Scanning dependencies of target mopac +make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' +make -f CMakeFiles/mopac.dir/build.make CMakeFiles/mopac.dir/build +make[3]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-param.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-param.dir/depend.internal". Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-param.dir/depend.internal". -Scanning dependencies of target mopac Scanning dependencies of target mopac-param +Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-api-test.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-api-test.dir/depend.internal". +Dependee "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-api-test.dir/depend.internal". make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -make -f CMakeFiles/mopac.dir/build.make CMakeFiles/mopac.dir/build make -f CMakeFiles/mopac-param.dir/build.make CMakeFiles/mopac-param.dir/build -Scanning dependencies of target mopac-api-test -make[3]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' make[3]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' +Scanning dependencies of target mopac-api-test make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' make -f CMakeFiles/mopac-api-test.dir/build.make CMakeFiles/mopac-api-test.dir/build make[3]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -[ 98%] Building Fortran object CMakeFiles/mopac-param.dir/src/param.F90.o [ 98%] Building Fortran object CMakeFiles/mopac.dir/src/mopac.F90.o /usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/mopac.F90 -o CMakeFiles/mopac.dir/src/mopac.F90.o +[ 98%] Building Fortran object CMakeFiles/mopac-param.dir/src/param.F90.o /usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/src/param.F90 -o CMakeFiles/mopac-param.dir/src/param.F90.o [ 98%] Building Fortran object CMakeFiles/mopac-api-test.dir/include/mopac_wrapper.F90.o /usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/include/mopac_wrapper.F90 -o CMakeFiles/mopac-api-test.dir/include/mopac_wrapper.F90.o +[ 98%] Linking Fortran executable mopac +/usr/bin/cmake -E cmake_link_script CMakeFiles/mopac.dir/link.txt --verbose=1 [ 99%] Linking Fortran executable mopac-param /usr/bin/cmake -E cmake_link_script CMakeFiles/mopac-param.dir/link.txt --verbose=1 -[ 99%] Linking Fortran executable mopac -/usr/bin/cmake -E cmake_link_script CMakeFiles/mopac.dir/link.txt --verbose=1 +/usr/bin/cmake -E cmake_copy_f90_mod mopac_api_f.mod CMakeFiles/mopac-api-test.dir/mopac_api_f.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/mopac-api-test.dir/include/mopac_wrapper.F90.o.provides.build /usr/bin/f95 -Wl,-z,relro -fopenmp -Wl,--dependency-file=CMakeFiles/mopac.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong CMakeFiles/mopac.dir/src/mopac.F90.o -o mopac -Wl,-rpath,:::::::::::::: libmopac.a /usr/lib/i386-linux-gnu/libblas.so /usr/lib/i386-linux-gnu/liblapack.so /usr/lib/i386-linux-gnu/libblas.so /usr/lib/i386-linux-gnu/liblapack.so -make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -[ 99%] Built target mopac /usr/bin/f95 -Wl,-z,relro -fopenmp -Wl,--dependency-file=CMakeFiles/mopac-param.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong "CMakeFiles/mopac-param.dir/src/param.F90.o" -o mopac-param -Wl,-rpath,:::::::::::::: libmopac.a /usr/lib/i386-linux-gnu/libblas.so /usr/lib/i386-linux-gnu/liblapack.so /usr/lib/i386-linux-gnu/libblas.so /usr/lib/i386-linux-gnu/liblapack.so make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -/usr/bin/cmake -E cmake_copy_f90_mod mopac_api_f.mod CMakeFiles/mopac-api-test.dir/mopac_api_f.mod.stamp GNU -[ 99%] Built target mopac-param -/usr/bin/cmake -E touch CMakeFiles/mopac-api-test.dir/include/mopac_wrapper.F90.o.provides.build +make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' [ 99%] Building Fortran object CMakeFiles/mopac-api-test.dir/include/mopac_wrapper_internal.F90.o -[100%] Building Fortran object CMakeFiles/mopac-api-test.dir/tests/mopac_api_test.F90.o +[ 99%] Built target mopac-param /usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/include/mopac_wrapper_internal.F90 -o CMakeFiles/mopac-api-test.dir/include/mopac_wrapper_internal.F90.o +[ 99%] Built target mopac +[100%] Building Fortran object CMakeFiles/mopac-api-test.dir/tests/mopac_api_test.F90.o /usr/bin/f95 -g -O2 -ffile-prefix-map=/build/reproducible-path/mopac-23.0.3=. -fstack-protector-strong -fopenmp -c /build/reproducible-path/mopac-23.0.3/tests/mopac_api_test.F90 -o CMakeFiles/mopac-api-test.dir/tests/mopac_api_test.F90.o /usr/bin/cmake -E cmake_copy_f90_mod mopac_api_c.mod CMakeFiles/mopac-api-test.dir/mopac_api_c.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod mopac_api_f@mopac_api_f_internal.smod CMakeFiles/mopac-api-test.dir/mopac_api_f@mopac_api_f_internal.smod.stamp GNU @@ -1652,10 +1688,10 @@ /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles 0 make[1]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' dh_auto_test - cd obj-i686-linux-gnu && make -j11 test ARGS\+=--verbose ARGS\+=-j11 + cd obj-i686-linux-gnu && make -j21 test ARGS\+=--verbose ARGS\+=-j21 make[1]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' Running tests... -/usr/bin/ctest --force-new-ctest-process --verbose -j11 +/usr/bin/ctest --force-new-ctest-process --verbose -j21 UpdateCTestConfiguration from :/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/DartConfiguration.tcl UpdateCTestConfiguration from :/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/DartConfiguration.tcl Test project /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu @@ -1732,193 +1768,368 @@ 6: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "convert_an_edited_PDB_file.mop" 6: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 6: Test timeout computed to be: 10000000 -4: Mon Jan 20 15:03:55 2025 Job: 'Test_XENO' started successfully -1: Mon Jan 20 15:03:55 2025 Job: 'port' started successfully -2: Mon Jan 20 15:03:55 2025 Job: 'Crambin_1SCF' started successfully -4: -4: -4: MOPAC Job: "Test_XENO.mop" ended normally on Jan 20, 2025, at 15:03. -4: -10: Mon Jan 20 15:03:55 2025 Job: 'PDB1CBN.ent' started successfully -13: Mon Jan 20 15:03:55 2025 Job: 'ADD-H_Bacteriorhodopsin_1AT9' started successfully -12: Mon Jan 20 15:03:55 2025 Job: 'ADD-H_Bacteriorhodopsin_1AP9' started successfully -11: Mon Jan 20 15:03:56 2025 Job: 'PDB1EJG.ent' started successfully -5: Mon Jan 20 15:03:56 2025 Job: 'Test_Hetero_group' started successfully -23: Mon Jan 20 15:03:56 2025 Job: 'IONIZE' started successfully -10: -10: -10: MOPAC Job: "PDB1CBN.ent" ended normally on Jan 20, 2025, at 15:03. -10: -6: Mon Jan 20 15:03:56 2025 Job: 'convert_an_edited_PDB_file' started successfully -5: -5: -5: MOPAC Job: "Test_Hetero_group.mop" ended normally on Jan 20, 2025, at 15:03. -5: -6: -6: -6: MOPAC Job: "convert_an_edited_PDB_file.mop" ended normally on Jan 20, 2025, at 15:03. -6: - 1/124 Test #4: xeno ............................. Passed 0.54 sec -11: -11: -11: MOPAC Job: "PDB1EJG.ent" ended normally on Jan 20, 2025, at 15:03. -11: test 7 Start 7: convert_unedited_pdb 7: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "convert_an_un-edited_PDB_file.mop" 7: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 7: Test timeout computed to be: 10000000 - 2/124 Test #5: hetero_group ..................... Passed 0.70 sec test 8 Start 8: ters_preserved 8: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Check_that_TERs_are_preserved.mop" "Check_TERs.pdb" 8: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 8: Test timeout computed to be: 10000000 -6: WARNING: numerical mismatch between -7.12533968 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and -6.98803573 on output line 525 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between 28.25378616 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 27.27225907 on output line 525 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between 28.08733588 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 29.36796565 on output line 525 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between -8.41248313 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and -7.9194903 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between 27.87173887 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 28.4653229 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between 29.04523373 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 28.45681742 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between -7.125 on reference line 743 in /build/reproducible-path/mopac-23.0.3/tests and -6.988 on output line 743 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between 28.254 on reference line 743 in /build/reproducible-path/mopac-23.0.3/tests and 27.272 on output line 743 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between 28.087 on reference line 743 in /build/reproducible-path/mopac-23.0.3/tests and 29.368 on output line 743 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between -8.412 on reference line 744 in /build/reproducible-path/mopac-23.0.3/tests and -7.919 on output line 744 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between 27.872 on reference line 744 in /build/reproducible-path/mopac-23.0.3/tests and 28.465 on output line 744 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -6: WARNING: numerical mismatch between 29.045 on reference line 744 in /build/reproducible-path/mopac-23.0.3/tests and 28.457 on output line 744 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 3/124 Test #6: convert_edited_pdb ............... Passed 0.77 sec test 9 Start 9: compare_proteins 9: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_two_protein_structures.mop" "Structure-1.txt" "Structure-2.txt" 9: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 9: Test timeout computed to be: 10000000 - 4/124 Test #10: pdb1cbn .......................... Passed 0.93 sec test 14 Start 14: add-h3 14: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Au_Add-H.mop" 14: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 14: Test timeout computed to be: 10000000 -8: Mon Jan 20 15:03:56 2025 Job: 'Check_that_TERs_are_preserved' started successfully -8: -8: -8: MOPAC Job: "Check_that_TERs_are_preserved.mop" ended normally on Jan 20, 2025, at 15:03. -8: -7: Mon Jan 20 15:03:56 2025 Job: 'convert_an_un-edited_PDB_file' started successfully -7: -7: -7: MOPAC Job: "convert_an_un-edited_PDB_file.mop" ended normally on Jan 20, 2025, at 15:03. -7: -9: Mon Jan 20 15:03:56 2025 Job: 'Compare_two_protein_structures' started successfully -9: -9: -9: MOPAC Job: "Compare_two_protein_structures.mop" ended normally on Jan 20, 2025, at 15:03. -9: - 5/124 Test #8: ters_preserved ................... Passed 0.44 sec test 22 Start 22: locate_ts 22: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Locate_TS.mop" "Cyclobutadiene_1.arc" "Cyclobutadiene_2.arc" 22: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 22: Test timeout computed to be: 10000000 - 6/124 Test #7: convert_unedited_pdb ............. Passed 0.61 sec test 25 Start 25: salt2 25: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "SALT_2.mop" 25: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 25: Test timeout computed to be: 10000000 - 7/124 Test #11: pdb1ejg .......................... Passed 1.19 sec +test 27 + Start 27: erratic-1 + +27: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "1.0" "erratic1.mop" +27: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +27: Test timeout computed to be: 10000000 +test 28 + Start 28: erratic-2 + +28: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "1.0" "erratic2.mop" +28: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +28: Test timeout computed to be: 10000000 +test 29 + Start 29: erratic-3 + +29: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "1.0" "erratic3.mop" +29: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +29: Test timeout computed to be: 10000000 +test 30 + Start 30: mopac-api-test + +30: Test command: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac-api-test +30: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +30: Test timeout computed to be: 10000000 +30: Passed API test 1 +30: Passed API test 2 +30: Passed API test 3 +30: Passed API test 4 +30: Passed API test 5 +30: Passed API test 6 +30: Passed API test 7 +30: Passed API test 8 +30: Passed API test 9 +6: Mon Feb 23 23:29:43 2026 Job: 'convert_an_edited_PDB_file' started successfully +8: Mon Feb 23 23:29:43 2026 Job: 'Check_that_TERs_are_preserved' started successfully +4: Mon Feb 23 23:29:43 2026 Job: 'Test_XENO' started successfully +2: Mon Feb 23 23:29:43 2026 Job: 'Crambin_1SCF' started successfully +25: +25: +25: MOPAC Job: "SALT_2.mop" ended normally on Feb 23, 2026, at 23:29. +25: +7: Mon Feb 23 23:29:43 2026 Job: 'convert_an_un-edited_PDB_file' started successfully +9: Mon Feb 23 23:29:43 2026 Job: 'Compare_two_protein_structures' started successfully +6: +6: +6: MOPAC Job: "convert_an_edited_PDB_file.mop" ended normally on Feb 23, 2026, at 23:29. +6: +4: +4: +4: MOPAC Job: "Test_XENO.mop" ended normally on Feb 23, 2026, at 23:29. +4: +29: +29: +29: MOPAC Job: "erratic3.mop" ended normally on Feb 23, 2026, at 23:29. +29: +13: Mon Feb 23 23:29:43 2026 Job: 'ADD-H_Bacteriorhodopsin_1AT9' started successfully +8: +8: +8: MOPAC Job: "Check_that_TERs_are_preserved.mop" ended normally on Feb 23, 2026, at 23:29. +8: +10: Mon Feb 23 23:29:43 2026 Job: 'PDB1CBN.ent' started successfully +1: Mon Feb 23 23:29:43 2026 Job: 'port' started successfully +7: +7: +7: MOPAC Job: "convert_an_un-edited_PDB_file.mop" ended normally on Feb 23, 2026, at 23:29. +7: +12: Mon Feb 23 23:29:43 2026 Job: 'ADD-H_Bacteriorhodopsin_1AP9' started successfully +28: Mon Feb 23 23:29:43 2026 Job: 'erratic2' started successfully +14: Mon Feb 23 23:29:43 2026 Job: 'Au_Add-H' started successfully + 1/124 Test #29: erratic-3 ........................ Passed 0.24 sec +test 31 + Start 31: ag20 + +31: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ag20.mop" +31: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +31: Test timeout computed to be: 10000000 +9: +9: +9: MOPAC Job: "Compare_two_protein_structures.mop" ended normally on Feb 23, 2026, at 23:29. +9: +23: Mon Feb 23 23:29:43 2026 Job: 'IONIZE' started successfully +11: Mon Feb 23 23:29:43 2026 Job: 'PDB1EJG.ent' started successfully + 2/124 Test #25: salt2 ............................ Passed 0.26 sec +test 32 + Start 32: ag20_cis_active + +32: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ag20_cis_active.mop" +32: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +32: Test timeout computed to be: 10000000 +5: Mon Feb 23 23:29:43 2026 Job: 'Test_Hetero_group' started successfully + 3/124 Test #9: compare_proteins ................. Passed 0.31 sec +test 33 + Start 33: benzene + +33: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "benzene.mop" +33: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +33: Test timeout computed to be: 10000000 +10: +10: +10: MOPAC Job: "PDB1CBN.ent" ended normally on Feb 23, 2026, at 23:29. +10: + 4/124 Test #7: convert_unedited_pdb ............. Passed 0.33 sec +test 34 + Start 34: co_cas + +34: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cas.mop" +34: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +34: Test timeout computed to be: 10000000 +6: WARNING: numerical mismatch between -7.12533968 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and -6.98803573 on output line 525 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between 28.25378616 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 27.27225907 on output line 525 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between 28.08733588 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 29.36796565 on output line 525 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between -8.41248313 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and -7.9194903 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between 27.87173887 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 28.4653229 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between 29.04523373 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 28.45681742 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between -7.125 on reference line 743 in /build/reproducible-path/mopac-23.0.3/tests and -6.988 on output line 743 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between 28.254 on reference line 743 in /build/reproducible-path/mopac-23.0.3/tests and 27.272 on output line 743 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between 28.087 on reference line 743 in /build/reproducible-path/mopac-23.0.3/tests and 29.368 on output line 743 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between -8.412 on reference line 744 in /build/reproducible-path/mopac-23.0.3/tests and -7.919 on output line 744 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between 27.872 on reference line 744 in /build/reproducible-path/mopac-23.0.3/tests and 28.465 on output line 744 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +6: WARNING: numerical mismatch between 29.045 on reference line 744 in /build/reproducible-path/mopac-23.0.3/tests and 28.457 on output line 744 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +5: +5: +5: MOPAC Job: "Test_Hetero_group.mop" ended normally on Feb 23, 2026, at 23:29. +5: +11: +11: +11: MOPAC Job: "PDB1EJG.ent" ended normally on Feb 23, 2026, at 23:29. +11: + 5/124 Test #4: xeno ............................. Passed 0.37 sec +test 35 + Start 35: co_cis + +35: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis.mop" +35: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +35: Test timeout computed to be: 10000000 + 6/124 Test #6: convert_edited_pdb ............... Passed 0.39 sec +test 36 + Start 36: co_cis_2 + +36: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_2.mop" +36: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +36: Test timeout computed to be: 10000000 + 7/124 Test #8: ters_preserved ................... Passed 0.40 sec +test 37 + Start 37: co_cis_PM7 + +37: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_PM7.mop" +37: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +37: Test timeout computed to be: 10000000 +14: +14: +14: MOPAC Job: "Au_Add-H.mop" ended normally on Feb 23, 2026, at 23:29. +14: +34: +34: +34: MOPAC Job: "co_cas.mop" ended normally on Feb 23, 2026, at 23:29. +34: +35: +35: +35: MOPAC Job: "co_cis.mop" ended normally on Feb 23, 2026, at 23:29. +35: + 8/124 Test #5: hetero_group ..................... Passed 0.57 sec +test 38 + Start 38: co_cis_active + +38: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_active.mop" +38: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +38: Test timeout computed to be: 10000000 +36: +36: +36: MOPAC Job: "co_cis_2.mop" ended normally on Feb 23, 2026, at 23:29. +36: + 9/124 Test #34: co_cas ........................... Passed 0.24 sec + 10/124 Test #35: co_cis ........................... Passed 0.21 sec +test 39 + Start 39: co_cis_solv + +39: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_solv.mop" +39: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +39: Test timeout computed to be: 10000000 +test 40 + Start 40: co_cis_tdip + +40: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_tdip.mop" +40: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +40: Test timeout computed to be: 10000000 + 11/124 Test #36: co_cis_2 ......................... Passed 0.22 sec +37: +37: +37: MOPAC Job: "co_cis_PM7.mop" ended normally on Feb 23, 2026, at 23:29. +37: +test 41 + Start 41: co_cis_trip + +41: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_trip.mop" +41: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +41: Test timeout computed to be: 10000000 +37: WARNING: numerical heat mismatch between -16.98521 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -16.98542 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +37: WARNING: numerical mismatch between -71.06612 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -71.06698 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 12/124 Test #10: pdb1cbn .......................... Passed 0.66 sec +test 42 + Start 42: co_cis_wrtconf + +42: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_wrtconf.mop" +42: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +42: Test timeout computed to be: 10000000 + 13/124 Test #37: co_cis_PM7 ....................... Passed 0.24 sec +test 43 + Start 43: co_cisd + +43: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cisd.mop" +43: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +43: Test timeout computed to be: 10000000 + 14/124 Test #11: pdb1ejg .......................... Passed 0.68 sec test 15 Start 15: compare_add-h 15: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_ADD-H_1EJG_and_1CBN.mop" 15: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 15: Test timeout computed to be: 10000000 - 8/124 Test #9: compare_proteins ................. Passed 0.40 sec +38: +38: +38: MOPAC Job: "co_cis_active.mop" ended normally on Feb 23, 2026, at 23:29. +38: +40: +40: +40: MOPAC Job: "co_cis_tdip.mop" ended normally on Feb 23, 2026, at 23:29. +40: +39: +39: +39: MOPAC Job: "co_cis_solv.mop" ended normally on Feb 23, 2026, at 23:29. +39: + 15/124 Test #38: co_cis_active .................... Passed 0.24 sec test 16 Start 16: pdb_compare 16: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_1EJG_and_1CBN.mop" 16: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 16: Test timeout computed to be: 10000000 -14: Mon Jan 20 15:03:56 2025 Job: 'Au_Add-H' started successfully +41: +41: +41: MOPAC Job: "co_cis_trip.mop" ended normally on Feb 23, 2026, at 23:29. +41: + 16/124 Test #40: co_cis_tdip ...................... Passed 0.22 sec +test 44 + Start 44: co_cisd_quin + +44: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cisd_quin.mop" +44: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +44: Test timeout computed to be: 10000000 +22: +22: +22: MOPAC Job: "Locate_TS.mop" ended normally on Feb 23, 2026, at 23:29. +22: +42: +42: +42: MOPAC Job: "co_cis_wrtconf.mop" ended normally on Feb 23, 2026, at 23:29. +42: + 17/124 Test #39: co_cis_solv ...................... Passed 0.25 sec +test 45 + Start 45: co_cisd_solv + +45: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cisd_solv.mop" +45: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +45: Test timeout computed to be: 10000000 23: 23: -23: MOPAC Job: "IONIZE.mop" ended normally on Jan 20, 2025, at 15:03. +23: MOPAC Job: "IONIZE.mop" ended normally on Feb 23, 2026, at 23:29. 23: - 9/124 Test #23: ionize ........................... Passed 1.44 sec + 18/124 Test #41: co_cis_trip ...................... Passed 0.23 sec +test 46 + Start 46: co_cisd_trip + +46: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cisd_trip.mop" +46: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +46: Test timeout computed to be: 10000000 + 19/124 Test #42: co_cis_wrtconf ................... Passed 0.22 sec +test 47 + Start 47: co_extern + +47: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_extern.mop" "param.txt" +47: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +47: Test timeout computed to be: 10000000 + 20/124 Test #23: ionize ........................... Passed 0.88 sec test 24 Start 24: salt 24: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "SALT.mop" 24: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 24: Test timeout computed to be: 10000000 -25: -25: -25: MOPAC Job: "SALT_2.mop" ended normally on Jan 20, 2025, at 15:03. -25: -16: Mon Jan 20 15:03:57 2025 Job: 'Compare_PDB_1EJG_and_1CBN' started successfully - 10/124 Test #25: salt2 ............................ Passed 0.49 sec +43: +43: +43: MOPAC Job: "co_cisd.mop" ended normally on Feb 23, 2026, at 23:29. +43: + 21/124 Test #22: locate_ts ........................ Passed 0.89 sec test 26 Start 26: residues 26: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "SITE_Individual_residues.mop" 26: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests 26: Test timeout computed to be: 10000000 -15: Mon Jan 20 15:03:57 2025 Job: 'Compare_ADD-H_1EJG_and_1CBN' started successfully -14: -14: -14: MOPAC Job: "Au_Add-H.mop" ended normally on Jan 20, 2025, at 15:03. -14: + 22/124 Test #43: co_cisd .......................... Passed 0.26 sec +test 48 + Start 48: co_fail + +48: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_fail.mop" +48: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev +48: Test timeout computed to be: 10000000 +15: Mon Feb 23 23:29:43 2026 Job: 'Compare_ADD-H_1EJG_and_1CBN' started successfully 13: 13: -13: MOPAC Job: "ADD-H_Bacteriorhodopsin_1AT9.mop" ended normally on Jan 20, 2025, at 15:03. +13: MOPAC Job: "ADD-H_Bacteriorhodopsin_1AT9.mop" ended normally on Feb 23, 2026, at 23:29. 13: -24: Mon Jan 20 15:03:57 2025 Job: 'SALT' started successfully -12: -12: -12: MOPAC Job: "ADD-H_Bacteriorhodopsin_1AP9.mop" ended normally on Jan 20, 2025, at 15:03. -12: -3: Mon Jan 20 15:03:57 2025 Job: 'test_Lewis_for_Proteins' started successfully -26: Mon Jan 20 15:03:57 2025 Job: 'SITE_Individual_residues' started successfully -15: -15: -15: MOPAC Job: "Compare_ADD-H_1EJG_and_1CBN.mop" ended normally on Jan 20, 2025, at 15:03. -15: -16: -16: -16: MOPAC Job: "Compare_PDB_1EJG_and_1CBN.mop" ended normally on Jan 20, 2025, at 15:03. -16: - 11/124 Test #15: compare_add-h .................... Passed 1.15 sec -test 27 - Start 27: erratic-1 - -27: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "1.0" "erratic1.mop" -27: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -27: Test timeout computed to be: 10000000 - 12/124 Test #16: pdb_compare ...................... Passed 1.21 sec -test 28 - Start 28: erratic-2 - -28: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "1.0" "erratic2.mop" -28: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -28: Test timeout computed to be: 10000000 -22: -22: -22: MOPAC Job: "Locate_TS.mop" ended normally on Jan 20, 2025, at 15:03. -22: -28: Mon Jan 20 15:03:58 2025 Job: 'erratic2' started successfully - 13/124 Test #22: locate_ts ........................ Passed 1.59 sec -test 29 - Start 29: erratic-3 - -29: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "1.0" "erratic3.mop" -29: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -29: Test timeout computed to be: 10000000 +33: +33: +33: MOPAC Job: "benzene.mop" ended normally on Feb 23, 2026, at 23:29. +33: +31: +31: +31: MOPAC Job: "ag20.mop" ended normally on Feb 23, 2026, at 23:29. +31: +44: Spin is incompatible with INDO +44: +44: +44: MOPAC Job: "co_cisd_quin.mop" ended normally on Feb 23, 2026, at 23:29. +44: 14: WARNING: numerical mismatch between -25.64788041 on reference line 2039 in /build/reproducible-path/mopac-23.0.3/tests and -25.90290178 on output line 2039 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 14: WARNING: numerical mismatch between 4.10092057 on reference line 2039 in /build/reproducible-path/mopac-23.0.3/tests and 4.98654585 on output line 2039 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 14: WARNING: numerical mismatch between -1.91380926 on reference line 2039 in /build/reproducible-path/mopac-23.0.3/tests and -3.20727348 on output line 2039 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac @@ -2191,283 +2402,7 @@ 14: WARNING: numerical mismatch between -19.41629408 on reference line 2893 in /build/reproducible-path/mopac-23.0.3/tests and -19.4207389 on output line 2893 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 14: WARNING: numerical mismatch between -8.6549534 on reference line 2893 in /build/reproducible-path/mopac-23.0.3/tests and -8.64182378 on output line 2893 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 14: WARNING: numerical mismatch between -20.4878079 on reference line 2893 in /build/reproducible-path/mopac-23.0.3/tests and -20.49668802 on output line 2893 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 14/124 Test #14: add-h3 ........................... Passed 1.90 sec -test 30 - Start 30: mopac-api-test - -30: Test command: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac-api-test -30: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -30: Test timeout computed to be: 10000000 -24: -24: -24: MOPAC Job: "SALT.mop" ended normally on Jan 20, 2025, at 15:03. -24: -30: Passed API test 1 -30: Passed API test 2 -30: Passed API test 3 -30: Passed API test 4 -30: Passed API test 5 - 15/124 Test #24: salt ............................. Passed 1.44 sec -test 31 - Start 31: ag20 - -31: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ag20.mop" -31: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -31: Test timeout computed to be: 10000000 -30: Passed API test 6 -30: Passed API test 7 -30: Passed API test 8 -30: Passed API test 9 -29: -29: -29: MOPAC Job: "erratic3.mop" ended normally on Jan 20, 2025, at 15:03. -29: - 16/124 Test #29: erratic-3 ........................ Passed 0.33 sec -test 32 - Start 32: ag20_cis_active - -32: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ag20_cis_active.mop" -32: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -32: Test timeout computed to be: 10000000 - 17/124 Test #12: add-h ............................ Passed 3.57 sec -test 33 - Start 33: benzene - -33: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "benzene.mop" -33: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -33: Test timeout computed to be: 10000000 - 18/124 Test #13: add-h2 ........................... Passed 3.69 sec -test 17 - Start 17: pdb_compare2 - -17: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_2AT9.mop" "Bacteriorhodopsin_2AT9.ent" -17: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -17: Test timeout computed to be: 10000000 -31: -31: -31: MOPAC Job: "ag20.mop" ended normally on Jan 20, 2025, at 15:03. -31: -17: Mon Jan 20 15:03:59 2025 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_2AT9' started successfully -26: -26: -26: MOPAC Job: "SITE_Individual_residues.mop" ended normally on Jan 20, 2025, at 15:03. -26: -31: WARNING: numerical mismatch between 2.918 on reference line 67 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 67 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -31: WARNING: numerical mismatch between 2.918 on reference line 68 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 68 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -31: WARNING: numerical mismatch between 2.918 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 19/124 Test #31: ag20 ............................. Passed 1.22 sec -test 18 - Start 18: pdb_compare3 - -18: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_1C3W.mop" "Bacteriorhodopsin_1C3W.ent" -18: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -18: Test timeout computed to be: 10000000 - 20/124 Test #26: residues ......................... Passed 2.49 sec -test 19 - Start 19: pdb_compare4 - -19: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRX.mop" "Bacteriorhodopsin_1BRX.ent" -19: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -19: Test timeout computed to be: 10000000 -33: -33: -33: MOPAC Job: "benzene.mop" ended normally on Jan 20, 2025, at 15:03. -33: -19: Mon Jan 20 15:04:00 2025 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRX' started successfully - 21/124 Test #33: benzene .......................... Passed 0.87 sec -test 20 - Start 20: pdb_compare5 - -20: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRR.mop" "Bacteriorhodopsin_1BRR.ent" -20: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -20: Test timeout computed to be: 10000000 -18: Mon Jan 20 15:04:00 2025 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_1C3W' started successfully -20: Mon Jan 20 15:04:00 2025 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRR' started successfully -19: -19: -19: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRX.mop" ended normally on Jan 20, 2025, at 15:04. -19: - 22/124 Test #19: pdb_compare4 ..................... Passed 3.10 sec -test 21 - Start 21: pdb_compare6 - -21: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_1AT9.mop" -21: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests -21: Test timeout computed to be: 10000000 -17: -17: -17: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_2AT9.mop" ended normally on Jan 20, 2025, at 15:04. -17: -18: -18: -18: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_1C3W.mop" ended normally on Jan 20, 2025, at 15:04. -18: -21: Mon Jan 20 15:04:03 2025 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_1AT9' started successfully - 23/124 Test #18: pdb_compare3 ..................... Passed 3.89 sec -test 34 - Start 34: co_cas - -34: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cas.mop" -34: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -34: Test timeout computed to be: 10000000 - 24/124 Test #17: pdb_compare2 ..................... Passed 4.31 sec -test 35 - Start 35: co_cis - -35: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis.mop" -35: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -35: Test timeout computed to be: 10000000 -20: -20: -20: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRR.mop" ended normally on Jan 20, 2025, at 15:04. -20: -34: -34: -34: MOPAC Job: "co_cas.mop" ended normally on Jan 20, 2025, at 15:04. -34: -35: -35: -35: MOPAC Job: "co_cis.mop" ended normally on Jan 20, 2025, at 15:04. -35: - 25/124 Test #34: co_cas ........................... Passed 0.40 sec -test 36 - Start 36: co_cis_2 - -36: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_2.mop" -36: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -36: Test timeout computed to be: 10000000 - 26/124 Test #35: co_cis ........................... Passed 0.46 sec -test 37 - Start 37: co_cis_PM7 - -37: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_PM7.mop" -37: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -37: Test timeout computed to be: 10000000 - 27/124 Test #20: pdb_compare5 ..................... Passed 4.03 sec -test 38 - Start 38: co_cis_active - -38: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_active.mop" -38: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -38: Test timeout computed to be: 10000000 -36: -36: -36: MOPAC Job: "co_cis_2.mop" ended normally on Jan 20, 2025, at 15:04. -36: - 28/124 Test #36: co_cis_2 ......................... Passed 0.35 sec -test 39 - Start 39: co_cis_solv - -39: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_solv.mop" -39: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -39: Test timeout computed to be: 10000000 -37: -37: -37: MOPAC Job: "co_cis_PM7.mop" ended normally on Jan 20, 2025, at 15:04. -37: -37: WARNING: numerical heat mismatch between -16.98521 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -16.98542 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -37: WARNING: numerical mismatch between -71.06612 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -71.06698 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 29/124 Test #37: co_cis_PM7 ....................... Passed 0.36 sec -test 40 - Start 40: co_cis_tdip - -40: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_tdip.mop" -40: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -40: Test timeout computed to be: 10000000 -38: -38: -38: MOPAC Job: "co_cis_active.mop" ended normally on Jan 20, 2025, at 15:04. -38: -39: -39: -39: MOPAC Job: "co_cis_solv.mop" ended normally on Jan 20, 2025, at 15:04. -39: - 30/124 Test #38: co_cis_active .................... Passed 0.59 sec -test 41 - Start 41: co_cis_trip - -41: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_trip.mop" -41: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -41: Test timeout computed to be: 10000000 - 31/124 Test #39: co_cis_solv ...................... Passed 0.34 sec -test 42 - Start 42: co_cis_wrtconf - -42: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cis_wrtconf.mop" -42: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -42: Test timeout computed to be: 10000000 -40: -40: -40: MOPAC Job: "co_cis_tdip.mop" ended normally on Jan 20, 2025, at 15:04. -40: - 32/124 Test #40: co_cis_tdip ...................... Passed 0.32 sec -test 43 - Start 43: co_cisd - -43: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cisd.mop" -43: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -43: Test timeout computed to be: 10000000 -41: -41: -41: MOPAC Job: "co_cis_trip.mop" ended normally on Jan 20, 2025, at 15:04. -41: -43: -43: -43: MOPAC Job: "co_cisd.mop" ended normally on Jan 20, 2025, at 15:04. -43: -42: -42: -42: MOPAC Job: "co_cis_wrtconf.mop" ended normally on Jan 20, 2025, at 15:04. -42: - 33/124 Test #41: co_cis_trip ...................... Passed 0.45 sec - 34/124 Test #43: co_cisd .......................... Passed 0.38 sec -test 44 - Start 44: co_cisd_quin - -44: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cisd_quin.mop" -44: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -44: Test timeout computed to be: 10000000 -test 45 - Start 45: co_cisd_solv - -45: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cisd_solv.mop" -45: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -45: Test timeout computed to be: 10000000 - 35/124 Test #42: co_cis_wrtconf ................... Passed 0.44 sec -test 46 - Start 46: co_cisd_trip - -46: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_cisd_trip.mop" -46: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -46: Test timeout computed to be: 10000000 -44: Spin is incompatible with INDO -44: -44: -44: MOPAC Job: "co_cisd_quin.mop" ended normally on Jan 20, 2025, at 15:04. -44: - 36/124 Test #44: co_cisd_quin ..................... Passed 0.30 sec -test 47 - Start 47: co_extern - -47: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_extern.mop" "param.txt" -47: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -47: Test timeout computed to be: 10000000 -45: -45: -45: MOPAC Job: "co_cisd_solv.mop" ended normally on Jan 20, 2025, at 15:04. -45: -46: -46: -46: MOPAC Job: "co_cisd_trip.mop" ended normally on Jan 20, 2025, at 15:04. -46: - 37/124 Test #45: co_cisd_solv ..................... Passed 0.36 sec -test 48 - Start 48: co_fail - -48: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_fail.mop" -48: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev -48: Test timeout computed to be: 10000000 - 38/124 Test #46: co_cisd_trip ..................... Passed 0.37 sec + 23/124 Test #33: benzene .......................... Passed 0.72 sec test 49 Start 49: co_field @@ -2476,644 +2411,694 @@ 49: Test timeout computed to be: 10000000 47: 47: -47: MOPAC Job: "co_extern.mop" ended normally on Jan 20, 2025, at 15:04. +47: MOPAC Job: "co_extern.mop" ended normally on Feb 23, 2026, at 23:29. 47: - 39/124 Test #47: co_extern ........................ Passed 0.34 sec + 24/124 Test #44: co_cisd_quin ..................... Passed 0.23 sec test 50 Start 50: co_mrci 50: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_mrci.mop" 50: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 50: Test timeout computed to be: 10000000 -49: -49: -49: MOPAC Job: "co_field.mop" ended normally on Jan 20, 2025, at 15:04. -49: - 40/124 Test #49: co_field ......................... Passed 0.36 sec +46: +46: +46: MOPAC Job: "co_cisd_trip.mop" ended normally on Feb 23, 2026, at 23:29. +46: +45: +45: +45: MOPAC Job: "co_cisd_solv.mop" ended normally on Feb 23, 2026, at 23:29. +45: + 25/124 Test #14: add-h3 ........................... Passed 1.06 sec test 51 Start 51: co_mrci_maxci 51: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_mrci_maxci.mop" 51: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 51: Test timeout computed to be: 10000000 -48: FORCE is incompatible with INDO -48: -48: -48: MOPAC Job: "co_fail.mop" ended normally on Jan 20, 2025, at 15:04. -48: - 41/124 Test #48: co_fail .......................... Passed 0.45 sec +31: WARNING: numerical mismatch between 2.918 on reference line 67 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 67 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +31: WARNING: numerical mismatch between 2.918 on reference line 68 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 68 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +31: WARNING: numerical mismatch between 2.918 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +16: Mon Feb 23 23:29:43 2026 Job: 'Compare_PDB_1EJG_and_1CBN' started successfully + 26/124 Test #47: co_extern ........................ Passed 0.22 sec test 52 Start 52: co_mrci_solv 52: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_mrci_solv.mop" 52: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 52: Test timeout computed to be: 10000000 -50: -50: -50: MOPAC Job: "co_mrci.mop" ended normally on Jan 20, 2025, at 15:04. -50: - 42/124 Test #50: co_mrci .......................... Passed 0.40 sec +48: FORCE is incompatible with INDO +48: +48: +48: MOPAC Job: "co_fail.mop" ended normally on Feb 23, 2026, at 23:29. +48: + 27/124 Test #46: co_cisd_trip ..................... Passed 0.25 sec test 53 Start 53: co_pm7 53: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_pm7.mop" 53: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 53: Test timeout computed to be: 10000000 -51: -51: -51: MOPAC Job: "co_mrci_maxci.mop" ended normally on Jan 20, 2025, at 15:04. -51: -52: -52: -52: MOPAC Job: "co_mrci_solv.mop" ended normally on Jan 20, 2025, at 15:04. -52: - 43/124 Test #51: co_mrci_maxci .................... Passed 0.43 sec + 28/124 Test #31: ag20 ............................. Passed 0.83 sec test 54 Start 54: co_pm7_solv 54: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_pm7_solv.mop" 54: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 54: Test timeout computed to be: 10000000 - 44/124 Test #52: co_mrci_solv ..................... Passed 0.40 sec + 29/124 Test #45: co_cisd_solv ..................... Passed 0.27 sec test 55 Start 55: co_print 55: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "co_print.mop" 55: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 55: Test timeout computed to be: 10000000 -53: -53: -53: MOPAC Job: "co_pm7.mop" ended normally on Jan 20, 2025, at 15:04. -53: -53: WARNING: numerical heat mismatch between -16.98521 on reference line 68 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -16.98542 on output line 68 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -53: WARNING: numerical mismatch between -71.06612 on reference line 68 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -71.06698 on output line 68 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 45/124 Test #53: co_pm7 ........................... Passed 0.31 sec +12: +12: +12: MOPAC Job: "ADD-H_Bacteriorhodopsin_1AP9.mop" ended normally on Feb 23, 2026, at 23:29. +12: + 30/124 Test #48: co_fail .......................... Passed 0.23 sec test 56 Start 56: no_cis_quar 56: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "no_cis_quar.mop" 56: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 56: Test timeout computed to be: 10000000 -55: WARNING: Specified print options may not behave as expected with INDO -55: -55: -55: MOPAC Job: "co_print.mop" ended normally on Jan 20, 2025, at 15:04. -55: - 46/124 Test #55: co_print ......................... Passed 0.32 sec +24: Mon Feb 23 23:29:44 2026 Job: 'SALT' started successfully +26: Mon Feb 23 23:29:44 2026 Job: 'SITE_Individual_residues' started successfully +15: +15: +15: MOPAC Job: "Compare_ADD-H_1EJG_and_1CBN.mop" ended normally on Feb 23, 2026, at 23:29. +15: +49: +49: +49: MOPAC Job: "co_field.mop" ended normally on Feb 23, 2026, at 23:29. +49: +51: +51: +51: MOPAC Job: "co_mrci_maxci.mop" ended normally on Feb 23, 2026, at 23:29. +51: +54: +54: +54: MOPAC Job: "co_pm7_solv.mop" ended normally on Feb 23, 2026, at 23:29. +54: + 31/124 Test #15: compare_add-h .................... Passed 0.61 sec + 32/124 Test #49: co_field ......................... Passed 0.24 sec test 57 Start 57: no_mrci 57: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "no_mrci.mop" 57: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 57: Test timeout computed to be: 10000000 -54: -54: -54: MOPAC Job: "co_pm7_solv.mop" ended normally on Jan 20, 2025, at 15:04. -54: -54: WARNING: numerical heat mismatch between -19.6414 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -19.64161 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -54: WARNING: numerical mismatch between -82.17963 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -82.1805 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -56: -56: -56: MOPAC Job: "no_cis_quar.mop" ended normally on Jan 20, 2025, at 15:04. -56: - 47/124 Test #54: co_pm7_solv ...................... Passed 0.48 sec test 58 Start 58: noparam 58: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "noparam.mop" 58: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 58: Test timeout computed to be: 10000000 - 48/124 Test #56: no_cis_quar ...................... Passed 0.33 sec +53: +53: +53: MOPAC Job: "co_pm7.mop" ended normally on Feb 23, 2026, at 23:29. +53: +53: WARNING: numerical heat mismatch between -16.98521 on reference line 68 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -16.98542 on output line 68 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +53: WARNING: numerical mismatch between -71.06612 on reference line 68 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -71.06698 on output line 68 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +54: WARNING: numerical heat mismatch between -19.6414 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -19.64161 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +54: WARNING: numerical mismatch between -82.17963 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and -82.1805 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +3: Mon Feb 23 23:29:44 2026 Job: 'test_Lewis_for_Proteins' started successfully +50: +50: +50: MOPAC Job: "co_mrci.mop" ended normally on Feb 23, 2026, at 23:29. +50: + 33/124 Test #51: co_mrci_maxci .................... Passed 0.24 sec test 59 Start 59: poly_c8 59: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "poly_c8.mop" 59: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 59: Test timeout computed to be: 10000000 -57: -57: -57: MOPAC Job: "no_mrci.mop" ended normally on Jan 20, 2025, at 15:04. -57: - 49/124 Test #57: no_mrci .......................... Passed 0.54 sec + 34/124 Test #54: co_pm7_solv ...................... Passed 0.22 sec test 60 Start 60: poly_c8_mr 60: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/INDO-dev" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "poly_c8_mr.mop" 60: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/INDO-dev 60: Test timeout computed to be: 10000000 -58: -58: -58: MOPAC Job: "noparam.mop" ended normally on Jan 20, 2025, at 15:04. -58: - 50/124 Test #58: noparam .......................... Passed 0.47 sec + 35/124 Test #53: co_pm7 ........................... Passed 0.23 sec test 61 Start 61: key-ampersand 61: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ampersand.mop" 61: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 61: Test timeout computed to be: 10000000 -61: -61: -61: MOPAC Job: "ampersand.mop" ended normally on Jan 20, 2025, at 15:04. -61: -61: WARNING: numerical heat mismatch between -77.16706 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -61: WARNING: numerical mismatch between -322.86699 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -61: WARNING: numerical heat mismatch between -77.16706 on reference line 211 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 211 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -61: WARNING: numerical mismatch between -322.86699 on reference line 211 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 211 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -61: WARNING: numerical heat mismatch between -77.16706 on reference line 352 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 352 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -61: WARNING: numerical mismatch between -322.86699 on reference line 352 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 352 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 51/124 Test #61: key-ampersand .................... Passed 0.75 sec +55: WARNING: Specified print options may not behave as expected with INDO +55: +55: +55: MOPAC Job: "co_print.mop" ended normally on Feb 23, 2026, at 23:29. +55: + 36/124 Test #50: co_mrci .......................... Passed 0.28 sec test 62 Start 62: key-plus 62: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "plus.mop" 62: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 62: Test timeout computed to be: 10000000 -62: -62: -62: MOPAC Job: "plus.mop" ended normally on Jan 20, 2025, at 15:04. -62: -62: WARNING: numerical heat mismatch between -77.16706 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -62: WARNING: numerical mismatch between -322.86699 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -62: WARNING: numerical heat mismatch between -77.16706 on reference line 211 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 211 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -62: WARNING: numerical mismatch between -322.86699 on reference line 211 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 211 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -62: WARNING: numerical heat mismatch between -77.16706 on reference line 353 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 353 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -62: WARNING: numerical mismatch between -322.86699 on reference line 353 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 353 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 52/124 Test #62: key-plus ......................... Passed 0.71 sec +56: +56: +56: MOPAC Job: "no_cis_quar.mop" ended normally on Feb 23, 2026, at 23:29. +56: +52: +52: +52: MOPAC Job: "co_mrci_solv.mop" ended normally on Feb 23, 2026, at 23:29. +52: +16: +16: +16: MOPAC Job: "Compare_PDB_1EJG_and_1CBN.mop" ended normally on Feb 23, 2026, at 23:29. +16: + 37/124 Test #56: no_cis_quar ...................... Passed 0.23 sec test 63 Start 63: key-plusplus 63: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "plusplus.mop" 63: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 63: Test timeout computed to be: 10000000 -63: -63: -63: MOPAC Job: "plusplus.mop" ended normally on Jan 20, 2025, at 15:04. -63: -63: WARNING: numerical heat mismatch between -77.16706 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -63: WARNING: numerical mismatch between -322.86699 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -63: WARNING: numerical heat mismatch between -77.16706 on reference line 210 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 210 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -63: WARNING: numerical mismatch between -322.86699 on reference line 210 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 210 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -63: WARNING: numerical heat mismatch between -77.16706 on reference line 350 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 350 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -63: WARNING: numerical mismatch between -322.86699 on reference line 350 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 350 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 53/124 Test #63: key-plusplus ..................... Passed 0.48 sec + 38/124 Test #55: co_print ......................... Passed 0.27 sec test 64 Start 64: key-0SCF 64: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "0SCF.mop" 64: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 64: Test timeout computed to be: 10000000 -64: -64: -64: MOPAC Job: "0SCF.mop" ended normally on Jan 20, 2025, at 15:04. -64: -32: -32: -32: MOPAC Job: "ag20_cis_active.mop" ended normally on Jan 20, 2025, at 15:04. -32: -64: WARNING: numerical heat mismatch between -77.16706 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -64: WARNING: numerical mismatch between -322.86699 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -64: WARNING: numerical heat mismatch between -77.16706 on reference line 264 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 264 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -64: WARNING: numerical mismatch between -322.86699 on reference line 264 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 264 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 54/124 Test #64: key-0SCF ......................... Passed 0.71 sec + 39/124 Test #52: co_mrci_solv ..................... Passed 0.33 sec test 65 Start 65: key-1ELECTRON 65: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "1ELECTRON.mop" 65: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 65: Test timeout computed to be: 10000000 -32: WARNING: numerical mismatch between 2.918 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -32: WARNING: numerical mismatch between 2.918 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -32: WARNING: numerical mismatch between 2.918 on reference line 71 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 71 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 55/124 Test #32: ag20_cis_active .................. Passed 11.29 sec + 40/124 Test #16: pdb_compare ...................... Passed 0.63 sec test 66 Start 66: key-1SCF 66: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "1SCF.mop" 66: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 66: Test timeout computed to be: 10000000 -66: -66: -66: MOPAC Job: "1SCF.mop" ended normally on Jan 20, 2025, at 15:04. -66: -65: -65: -65: MOPAC Job: "1ELECTRON.mop" ended normally on Jan 20, 2025, at 15:04. -65: -66: WARNING: numerical heat mismatch between -84.34612 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.34643 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -66: WARNING: numerical mismatch between -352.90418 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -352.90546 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -65: WARNING: numerical heat mismatch between -84.51541 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51572 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -65: WARNING: numerical mismatch between -353.61248 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61376 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -65: WARNING: numerical heat mismatch between -84.51541 on reference line 234 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51572 on output line 234 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -65: WARNING: numerical mismatch between -353.61248 on reference line 234 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61376 on output line 234 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 56/124 Test #66: key-1SCF ......................... Passed 0.37 sec +58: +58: +58: MOPAC Job: "noparam.mop" ended normally on Feb 23, 2026, at 23:29. +58: + 41/124 Test #58: noparam .......................... Passed 0.24 sec test 67 Start 67: key-A0 67: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "A0.mop" 67: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 67: Test timeout computed to be: 10000000 - 57/124 Test #65: key-1ELECTRON .................... Passed 0.45 sec +61: +61: +61: MOPAC Job: "ampersand.mop" ended normally on Feb 23, 2026, at 23:29. +61: +62: +62: +62: MOPAC Job: "plus.mop" ended normally on Feb 23, 2026, at 23:29. +62: +61: WARNING: numerical heat mismatch between -77.16706 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +61: WARNING: numerical mismatch between -322.86699 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +61: WARNING: numerical heat mismatch between -77.16706 on reference line 211 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 211 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +61: WARNING: numerical mismatch between -322.86699 on reference line 211 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 211 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +61: WARNING: numerical heat mismatch between -77.16706 on reference line 352 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 352 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +61: WARNING: numerical mismatch between -322.86699 on reference line 352 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 352 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 42/124 Test #61: key-ampersand .................... Passed 0.27 sec test 68 Start 68: key-AIGIN 68: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "AIGIN.mop" 68: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 68: Test timeout computed to be: 10000000 -67: -67: -67: MOPAC Job: "A0.mop" ended normally on Jan 20, 2025, at 15:04. -67: -67: WARNING: numerical heat mismatch between -84.51541 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51571 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -67: WARNING: numerical mismatch between -353.61246 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61374 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 58/124 Test #67: key-A0 ........................... Passed 0.32 sec +57: +57: +57: MOPAC Job: "no_mrci.mop" ended normally on Feb 23, 2026, at 23:29. +57: +62: WARNING: numerical heat mismatch between -77.16706 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +62: WARNING: numerical mismatch between -322.86699 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +62: WARNING: numerical heat mismatch between -77.16706 on reference line 211 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 211 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +62: WARNING: numerical mismatch between -322.86699 on reference line 211 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 211 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +62: WARNING: numerical heat mismatch between -77.16706 on reference line 353 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 353 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +62: WARNING: numerical mismatch between -322.86699 on reference line 353 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 353 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +63: +63: +63: MOPAC Job: "plusplus.mop" ended normally on Feb 23, 2026, at 23:29. +63: + 43/124 Test #62: key-plus ......................... Passed 0.28 sec test 69 Start 69: key-AIGOUT 69: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "AIGOUT.mop" 69: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 69: Test timeout computed to be: 10000000 -68: -68: -68: MOPAC Job: "AIGIN.mop" ended normally on Jan 20, 2025, at 15:04. -68: -68: WARNING: numerical heat mismatch between -18.19788 on reference line 106 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19844 on output line 106 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -68: WARNING: numerical mismatch between -76.13994 on reference line 106 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.14227 on output line 106 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 59/124 Test #68: key-AIGIN ........................ Passed 0.35 sec + 44/124 Test #57: no_mrci .......................... Passed 0.35 sec test 70 Start 70: key-ALLBONDS 70: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ALLBONDS.mop" 70: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 70: Test timeout computed to be: 10000000 -69: -69: -69: MOPAC Job: "AIGOUT.mop" ended normally on Jan 20, 2025, at 15:04. -69: -70: -70: -70: MOPAC Job: "ALLBONDS.mop" ended normally on Jan 20, 2025, at 15:04. -70: -69: WARNING: numerical heat mismatch between -18.19788 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19844 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -69: WARNING: numerical mismatch between -76.13994 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.14227 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 60/124 Test #69: key-AIGOUT ....................... Passed 0.51 sec +65: +65: +65: MOPAC Job: "1ELECTRON.mop" ended normally on Feb 23, 2026, at 23:29. +65: +63: WARNING: numerical heat mismatch between -77.16706 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +63: WARNING: numerical mismatch between -322.86699 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +63: WARNING: numerical heat mismatch between -77.16706 on reference line 210 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 210 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +63: WARNING: numerical mismatch between -322.86699 on reference line 210 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 210 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +63: WARNING: numerical heat mismatch between -77.16706 on reference line 350 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 350 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +63: WARNING: numerical mismatch between -322.86699 on reference line 350 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 350 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 45/124 Test #63: key-plusplus ..................... Passed 0.30 sec test 71 Start 71: key-ALLVEC 71: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ALLVEC.mop" 71: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 71: Test timeout computed to be: 10000000 -70: WARNING: numerical heat mismatch between -18.19689 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19745 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -70: WARNING: numerical mismatch between -76.13581 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.13814 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -70: WARNING: numerical heat mismatch between -18.19689 on reference line 252 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19745 on output line 252 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -70: WARNING: numerical mismatch between -76.13581 on reference line 252 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.13814 on output line 252 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -70: WARNING: numerical heat mismatch between -18.19689 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19745 on output line 426 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -70: WARNING: numerical mismatch between -76.13581 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.13814 on output line 426 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 61/124 Test #70: key-ALLBONDS ..................... Passed 0.52 sec +65: WARNING: numerical heat mismatch between -84.51541 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51572 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +65: WARNING: numerical mismatch between -353.61248 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61376 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +65: WARNING: numerical heat mismatch between -84.51541 on reference line 234 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51572 on output line 234 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +65: WARNING: numerical mismatch between -353.61248 on reference line 234 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61376 on output line 234 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 46/124 Test #65: key-1ELECTRON .................... Passed 0.29 sec test 72 Start 72: key-AM1 72: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "AM1.mop" 72: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 72: Test timeout computed to be: 10000000 -71: -71: -71: MOPAC Job: "ALLVEC.mop" ended normally on Jan 20, 2025, at 15:04. -71: -72: -72: -72: MOPAC Job: "AM1.mop" ended normally on Jan 20, 2025, at 15:04. -72: -59: -59: -59: MOPAC Job: "poly_c8.mop" ended normally on Jan 20, 2025, at 15:04. -59: -72: WARNING: numerical heat mismatch between -79.8614 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -79.86171 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -72: WARNING: numerical mismatch between -334.1401 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -334.14139 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -71: WARNING: numerical heat mismatch between -18.19788 on reference line 85 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19844 on output line 85 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -71: WARNING: numerical mismatch between -76.13994 on reference line 85 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.14227 on output line 85 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -71: WARNING: numerical heat mismatch between -18.19788 on reference line 262 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19844 on output line 262 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -71: WARNING: numerical mismatch between -76.13994 on reference line 262 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.14227 on output line 262 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 62/124 Test #72: key-AM1 .......................... Passed 0.35 sec +66: +66: +66: MOPAC Job: "1SCF.mop" ended normally on Feb 23, 2026, at 23:29. +66: +66: WARNING: numerical heat mismatch between -84.34612 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.34643 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +66: WARNING: numerical mismatch between -352.90418 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -352.90546 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +24: +24: +24: MOPAC Job: "SALT.mop" ended normally on Feb 23, 2026, at 23:29. +24: + 47/124 Test #13: add-h2 ........................... Passed 1.74 sec test 73 Start 73: key-ANGSTROMS 73: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ANGSTROMS.mop" 73: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 73: Test timeout computed to be: 10000000 - 63/124 Test #71: key-ALLVEC ....................... Passed 0.44 sec +67: +67: +67: MOPAC Job: "A0.mop" ended normally on Feb 23, 2026, at 23:29. +67: + 48/124 Test #66: key-1SCF ......................... Passed 0.31 sec test 74 Start 74: key-AUTOSYM 74: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "AUTOSYM.mop" 74: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 74: Test timeout computed to be: 10000000 - 64/124 Test #59: poly_c8 .......................... Passed 5.01 sec +67: WARNING: numerical heat mismatch between -84.51541 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51571 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +67: WARNING: numerical mismatch between -353.61246 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61374 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 49/124 Test #24: salt ............................. Passed 0.88 sec test 75 Start 75: key-BIRADICAL 75: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "BIRADICAL.mop" 75: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 75: Test timeout computed to be: 10000000 -73: -73: -73: MOPAC Job: "ANGSTROMS.mop" ended normally on Jan 20, 2025, at 15:04. -73: -73: WARNING: numerical heat mismatch between -84.51541 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51572 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -73: WARNING: numerical mismatch between -353.61248 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61376 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 65/124 Test #73: key-ANGSTROMS .................... Passed 0.36 sec +64: +64: +64: MOPAC Job: "0SCF.mop" ended normally on Feb 23, 2026, at 23:29. +64: + 50/124 Test #67: key-A0 ........................... Passed 0.24 sec test 76 Start 76: key-CdotAdotSdot 76: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "CdotAdotSdot.mop" 76: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 76: Test timeout computed to be: 10000000 -74: -74: -74: MOPAC Job: "AUTOSYM.mop" ended normally on Jan 20, 2025, at 15:04. -74: -74: WARNING: numerical heat mismatch between 22.9565 on reference line 102 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 22.95541 on output line 102 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -74: WARNING: numerical mismatch between 96.05001 on reference line 102 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 96.04545 on output line 102 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 66/124 Test #74: key-AUTOSYM ...................... Passed 0.58 sec +64: WARNING: numerical heat mismatch between -77.16706 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +64: WARNING: numerical mismatch between -322.86699 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +64: WARNING: numerical heat mismatch between -77.16706 on reference line 264 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -77.16737 on output line 264 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +64: WARNING: numerical mismatch between -322.86699 on reference line 264 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -322.86826 on output line 264 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +69: +69: +69: MOPAC Job: "AIGOUT.mop" ended normally on Feb 23, 2026, at 23:29. +69: +69: WARNING: numerical heat mismatch between -18.19788 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19844 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +69: WARNING: numerical mismatch between -76.13994 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.14227 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 51/124 Test #12: add-h ............................ Passed 1.85 sec +test 17 + Start 17: pdb_compare2 + +17: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_2AT9.mop" "Bacteriorhodopsin_2AT9.ent" +17: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +17: Test timeout computed to be: 10000000 + 52/124 Test #64: key-0SCF ......................... Passed 0.47 sec +test 18 + Start 18: pdb_compare3 + +18: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_1C3W.mop" "Bacteriorhodopsin_1C3W.ent" +18: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +18: Test timeout computed to be: 10000000 +68: +68: +68: MOPAC Job: "AIGIN.mop" ended normally on Feb 23, 2026, at 23:29. +68: + 53/124 Test #69: key-AIGOUT ....................... Passed 0.25 sec +test 19 + Start 19: pdb_compare4 + +19: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRX.mop" "Bacteriorhodopsin_1BRX.ent" +19: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +19: Test timeout computed to be: 10000000 +68: WARNING: numerical heat mismatch between -18.19788 on reference line 106 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19844 on output line 106 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +68: WARNING: numerical mismatch between -76.13994 on reference line 106 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.14227 on output line 106 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +71: +71: +71: MOPAC Job: "ALLVEC.mop" ended normally on Feb 23, 2026, at 23:29. +71: + 54/124 Test #68: key-AIGIN ........................ Passed 0.31 sec +test 20 + Start 20: pdb_compare5 + +20: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRR.mop" "Bacteriorhodopsin_1BRR.ent" +20: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +20: Test timeout computed to be: 10000000 +72: +72: +72: MOPAC Job: "AM1.mop" ended normally on Feb 23, 2026, at 23:29. +72: +72: WARNING: numerical heat mismatch between -79.8614 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -79.86171 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +72: WARNING: numerical mismatch between -334.1401 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -334.14139 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +70: +70: +70: MOPAC Job: "ALLBONDS.mop" ended normally on Feb 23, 2026, at 23:29. +70: +71: WARNING: numerical heat mismatch between -18.19788 on reference line 85 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19844 on output line 85 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +71: WARNING: numerical mismatch between -76.13994 on reference line 85 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.14227 on output line 85 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +71: WARNING: numerical heat mismatch between -18.19788 on reference line 262 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19844 on output line 262 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +71: WARNING: numerical mismatch between -76.13994 on reference line 262 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.14227 on output line 262 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +73: +73: +73: MOPAC Job: "ANGSTROMS.mop" ended normally on Feb 23, 2026, at 23:29. +73: + 55/124 Test #72: key-AM1 .......................... Passed 0.24 sec +test 21 + Start 21: pdb_compare6 + +21: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "Compare_PDB_Bacteriorhodopsin_1AP9_and_1AT9.mop" +21: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests +21: Test timeout computed to be: 10000000 +73: WARNING: numerical heat mismatch between -84.51541 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51572 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +73: WARNING: numerical mismatch between -353.61248 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61376 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 56/124 Test #71: key-ALLVEC ....................... Passed 0.27 sec test 77 Start 77: key-CdotIdot 77: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "CdotIdot.mop" 77: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 77: Test timeout computed to be: 10000000 -77: -77: -77: MOPAC Job: "CdotIdot.mop" ended normally on Jan 20, 2025, at 15:04. -77: -77: WARNING: numerical heat mismatch between 14.6638 on reference line 76 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 14.66335 on output line 76 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -77: WARNING: numerical mismatch between 61.35332 on reference line 76 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 61.35146 on output line 76 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -77: WARNING: numerical heat mismatch between 8.74306 on reference line 235 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.74262 on output line 235 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -77: WARNING: numerical mismatch between 36.58098 on reference line 235 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.57911 on output line 235 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -77: WARNING: numerical heat mismatch between 8.74306 on reference line 394 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.74262 on output line 394 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -77: WARNING: numerical mismatch between 36.58098 on reference line 394 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.57911 on output line 394 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 67/124 Test #77: key-CdotIdot ..................... Passed 0.51 sec + 57/124 Test #73: key-ANGSTROMS .................... Passed 0.24 sec test 78 Start 78: key-CdotIdotDdot 78: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "CdotIdotDdot.mop" 78: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 78: Test timeout computed to be: 10000000 -78: -78: -78: MOPAC Job: "CdotIdotDdot.mop" ended normally on Jan 20, 2025, at 15:04. -78: - 68/124 Test #78: key-CdotIdotDdot ................. Passed 0.44 sec +74: +74: +74: MOPAC Job: "AUTOSYM.mop" ended normally on Feb 23, 2026, at 23:29. +74: +70: WARNING: numerical heat mismatch between -18.19689 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19745 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +70: WARNING: numerical mismatch between -76.13581 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.13814 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +70: WARNING: numerical heat mismatch between -18.19689 on reference line 252 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19745 on output line 252 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +70: WARNING: numerical mismatch between -76.13581 on reference line 252 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.13814 on output line 252 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +70: WARNING: numerical heat mismatch between -18.19689 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -18.19745 on output line 426 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +70: WARNING: numerical mismatch between -76.13581 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -76.13814 on output line 426 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +74: WARNING: numerical heat mismatch between 22.9565 on reference line 102 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 22.95541 on output line 102 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +74: WARNING: numerical mismatch between 96.05001 on reference line 102 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 96.04545 on output line 102 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 58/124 Test #70: key-ALLBONDS ..................... Passed 0.37 sec test 79 Start 79: key-CHARGE 79: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "CHARGE.mop" 79: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 79: Test timeout computed to be: 10000000 -75: -75: -75: MOPAC Job: "BIRADICAL.mop" ended normally on Jan 20, 2025, at 15:04. -75: -79: -79: -79: MOPAC Job: "CHARGE.mop" ended normally on Jan 20, 2025, at 15:04. -79: -75: WARNING: numerical heat mismatch between 86.55356 on reference line 118 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 86.55281 on output line 118 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -75: WARNING: numerical mismatch between 362.14011 on reference line 118 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 362.13696 on output line 118 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -75: WARNING: numerical heat mismatch between 86.55356 on reference line 334 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 86.55281 on output line 334 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -75: WARNING: numerical mismatch between 362.14011 on reference line 334 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 362.13696 on output line 334 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -28: -28: -28: MOPAC Job: "erratic2.mop" ended normally on Jan 20, 2025, at 15:04. -28: -79: WARNING: numerical mismatch between 869.38904 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 869.38917 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -79: WARNING: numerical heat mismatch between 360.4549 on reference line 210 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 360.45506 on output line 210 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -79: WARNING: numerical mismatch between 1508.14332 on reference line 210 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1508.14397 on output line 210 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -79: WARNING: numerical mismatch between 981.81163 on reference line 359 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 981.81185 on output line 359 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 69/124 Test #75: key-BIRADICAL .................... Passed 1.70 sec + 59/124 Test #74: key-AUTOSYM ...................... Passed 0.28 sec test 80 Start 80: key-CIS 80: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "CIS.mop" 80: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 80: Test timeout computed to be: 10000000 - 70/124 Test #79: key-CHARGE ....................... Passed 0.41 sec +18: Mon Feb 23 23:29:45 2026 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_1C3W' started successfully +20: Mon Feb 23 23:29:45 2026 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRR' started successfully +19: Mon Feb 23 23:29:45 2026 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRX' started successfully +17: Mon Feb 23 23:29:45 2026 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_2AT9' started successfully +78: +78: +78: MOPAC Job: "CdotIdotDdot.mop" ended normally on Feb 23, 2026, at 23:29. +78: +77: +77: +77: MOPAC Job: "CdotIdot.mop" ended normally on Feb 23, 2026, at 23:29. +77: +80: +80: +80: MOPAC Job: "CIS.mop" ended normally on Feb 23, 2026, at 23:29. +80: +21: Mon Feb 23 23:29:45 2026 Job: 'Compare_PDB_Bacteriorhodopsin_1AP9_and_1AT9' started successfully +26: +26: +26: MOPAC Job: "SITE_Individual_residues.mop" ended normally on Feb 23, 2026, at 23:29. +26: +77: WARNING: numerical heat mismatch between 14.6638 on reference line 76 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 14.66335 on output line 76 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +77: WARNING: numerical mismatch between 61.35332 on reference line 76 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 61.35146 on output line 76 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +77: WARNING: numerical heat mismatch between 8.74306 on reference line 235 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.74262 on output line 235 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +77: WARNING: numerical mismatch between 36.58098 on reference line 235 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.57911 on output line 235 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +77: WARNING: numerical heat mismatch between 8.74306 on reference line 394 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.74262 on output line 394 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +77: WARNING: numerical mismatch between 36.58098 on reference line 394 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.57911 on output line 394 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +79: +79: +79: MOPAC Job: "CHARGE.mop" ended normally on Feb 23, 2026, at 23:29. +79: + 60/124 Test #78: key-CdotIdotDdot ................. Passed 0.31 sec test 81 Start 81: key-CISD 81: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "CISD.mop" 81: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 81: Test timeout computed to be: 10000000 -28: WARNING: numerical mismatch between 535.23 on reference line 257 in /build/reproducible-path/mopac-23.0.3/tests and 535.22 on output line 257 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 71/124 Test #28: erratic-2 ........................ Passed 15.64 sec +80: WARNING: numerical heat mismatch between 8.74306 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.74262 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +80: WARNING: numerical mismatch between 36.58098 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.57911 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +80: WARNING: numerical heat mismatch between 14.6638 on reference line 273 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 14.66335 on output line 273 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +80: WARNING: numerical mismatch between 61.35332 on reference line 273 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 61.35146 on output line 273 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 61/124 Test #77: key-CdotIdot ..................... Passed 0.35 sec test 82 Start 82: key-CISDT 82: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "CISDT.mop" 82: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 82: Test timeout computed to be: 10000000 -80: -80: -80: MOPAC Job: "CIS.mop" ended normally on Jan 20, 2025, at 15:04. -80: -80: WARNING: numerical heat mismatch between 8.74306 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.74262 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -80: WARNING: numerical mismatch between 36.58098 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.57911 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -80: WARNING: numerical heat mismatch between 14.6638 on reference line 273 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 14.66335 on output line 273 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -80: WARNING: numerical mismatch between 61.35332 on reference line 273 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 61.35146 on output line 273 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 72/124 Test #80: key-CIS .......................... Passed 0.35 sec + 62/124 Test #26: residues ......................... Passed 1.39 sec test 83 Start 83: key-DISP 83: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "DISP.mop" 83: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 83: Test timeout computed to be: 10000000 -81: -81: -81: MOPAC Job: "CISD.mop" ended normally on Jan 20, 2025, at 15:04. -81: -81: WARNING: numerical heat mismatch between 7.84782 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 7.84737 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -81: WARNING: numerical mismatch between 32.83528 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.8334 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -81: WARNING: numerical heat mismatch between 7.85711 on reference line 401 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 7.85666 on output line 401 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -81: WARNING: numerical mismatch between 32.87415 on reference line 401 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.87228 on output line 401 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: -83: -83: MOPAC Job: "DISP.mop" ended normally on Jan 20, 2025, at 15:04. -83: - 73/124 Test #81: key-CISD ......................... Passed 0.67 sec +79: WARNING: numerical mismatch between 869.38904 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 869.38917 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +79: WARNING: numerical heat mismatch between 360.4549 on reference line 210 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 360.45506 on output line 210 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +79: WARNING: numerical mismatch between 1508.14332 on reference line 210 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1508.14397 on output line 210 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +79: WARNING: numerical mismatch between 981.81163 on reference line 359 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 981.81185 on output line 359 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 63/124 Test #80: key-CIS .......................... Passed 0.29 sec test 84 Start 84: key-DOUBLET 84: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "DOUBLET.mop" 84: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 84: Test timeout computed to be: 10000000 -83: WARNING: numerical heat mismatch between -192.3822 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -192.38299 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -804.92711 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -804.93045 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -33809.56058 on reference line 88 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -33809.58819 on output line 88 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between 33624.30811 on reference line 89 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 33624.33492 on output line 89 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -185.25248 on reference line 90 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -185.25327 on output line 90 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -192.3822 on reference line 94 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -192.38299 on output line 94 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -4519.7709 on reference line 100 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -4519.77115 on output line 100 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between 3053.64839 on reference line 101 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 3053.64864 on output line 101 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical heat mismatch between -192.3822 on reference line 285 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -192.38299 on output line 285 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -804.92711 on reference line 285 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -804.93045 on output line 285 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -33809.56058 on reference line 287 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -33809.58819 on output line 287 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between 33624.30811 on reference line 288 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 33624.33492 on output line 288 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -185.25248 on reference line 289 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -185.25327 on output line 289 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -192.3822 on reference line 293 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -192.38299 on output line 293 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between -4519.7709 on reference line 304 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -4519.77115 on output line 304 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -83: WARNING: numerical mismatch between 3053.64839 on reference line 305 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 3053.64864 on output line 305 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 74/124 Test #83: key-DISP ......................... Passed 0.44 sec + 64/124 Test #79: key-CHARGE ....................... Passed 0.33 sec test 85 Start 85: key-EXTERNAL 85: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "EXTERNAL.mop" "EXTERNAL.dat" 85: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 85: Test timeout computed to be: 10000000 -30: Passed API test 10 - 75/124 Test #30: mopac-api-test ................... Passed 16.01 sec +81: +81: +81: MOPAC Job: "CISD.mop" ended normally on Feb 23, 2026, at 23:29. +81: +81: WARNING: numerical heat mismatch between 7.84782 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 7.84737 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +81: WARNING: numerical mismatch between 32.83528 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.8334 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +81: WARNING: numerical heat mismatch between 7.85711 on reference line 401 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 7.85666 on output line 401 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +81: WARNING: numerical mismatch between 32.87415 on reference line 401 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.87228 on output line 401 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +85: +85: +85: MOPAC Job: "EXTERNAL.mop" ended normally on Feb 23, 2026, at 23:29. +85: + 65/124 Test #81: key-CISD ......................... Passed 0.29 sec test 86 Start 86: key-EXTERNAL-2 86: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "EXTERNAL_2.mop" 86: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 86: Test timeout computed to be: 10000000 -85: -85: -85: MOPAC Job: "EXTERNAL.mop" ended normally on Jan 20, 2025, at 15:04. -85: - 76/124 Test #85: key-EXTERNAL ..................... Passed 0.39 sec -test 87 - Start 87: key-INDO - -87: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "INDO.mop" -87: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords -87: Test timeout computed to be: 10000000 84: 84: -84: MOPAC Job: "DOUBLET.mop" ended normally on Jan 20, 2025, at 15:04. +84: MOPAC Job: "DOUBLET.mop" ended normally on Feb 23, 2026, at 23:29. 84: -86: -86: -86: MOPAC Job: "EXTERNAL_2.mop" ended normally on Jan 20, 2025, at 15:04. -86: +83: +83: +83: MOPAC Job: "DISP.mop" ended normally on Feb 23, 2026, at 23:29. +83: 84: WARNING: numerical mismatch between 463.20296 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 463.20324 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 84: WARNING: numerical mismatch between 463.20296 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 463.20324 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 84: WARNING: numerical mismatch between 580.44941 on reference line 371 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 580.44979 on output line 371 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 84: WARNING: numerical mismatch between 580.44941 on reference line 503 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 580.44979 on output line 503 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 84: WARNING: numerical mismatch between 580.44941 on reference line 638 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 580.44979 on output line 638 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 84: WARNING: numerical mismatch between 580.44941 on reference line 801 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 580.44979 on output line 801 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 77/124 Test #84: key-DOUBLET ...................... Passed 0.59 sec +75: +75: +75: MOPAC Job: "BIRADICAL.mop" ended normally on Feb 23, 2026, at 23:29. +75: + 66/124 Test #85: key-EXTERNAL ..................... Passed 0.29 sec +test 87 + Start 87: key-INDO + +87: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "INDO.mop" +87: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords +87: Test timeout computed to be: 10000000 +83: WARNING: numerical heat mismatch between -192.3822 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -192.38299 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -804.92711 on reference line 86 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -804.93045 on output line 86 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -33809.56058 on reference line 88 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -33809.58819 on output line 88 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between 33624.30811 on reference line 89 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 33624.33492 on output line 89 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -185.25248 on reference line 90 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -185.25327 on output line 90 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -192.3822 on reference line 94 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -192.38299 on output line 94 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -4519.7709 on reference line 100 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -4519.77115 on output line 100 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between 3053.64839 on reference line 101 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 3053.64864 on output line 101 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical heat mismatch between -192.3822 on reference line 285 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -192.38299 on output line 285 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -804.92711 on reference line 285 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -804.93045 on output line 285 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -33809.56058 on reference line 287 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -33809.58819 on output line 287 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between 33624.30811 on reference line 288 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 33624.33492 on output line 288 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -185.25248 on reference line 289 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -185.25327 on output line 289 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -192.3822 on reference line 293 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -192.38299 on output line 293 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between -4519.7709 on reference line 304 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -4519.77115 on output line 304 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +83: WARNING: numerical mismatch between 3053.64839 on reference line 305 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 3053.64864 on output line 305 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 67/124 Test #84: key-DOUBLET ...................... Passed 0.32 sec test 88 Start 88: key-MAXCI 88: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "MAXCI.mop" 88: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 88: Test timeout computed to be: 10000000 - 78/124 Test #86: key-EXTERNAL-2 ................... Passed 0.41 sec +75: WARNING: numerical heat mismatch between 86.55356 on reference line 118 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 86.55281 on output line 118 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +75: WARNING: numerical mismatch between 362.14011 on reference line 118 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 362.13696 on output line 118 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +75: WARNING: numerical heat mismatch between 86.55356 on reference line 334 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 86.55281 on output line 334 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +75: WARNING: numerical mismatch between 362.14011 on reference line 334 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 362.13696 on output line 334 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 68/124 Test #83: key-DISP ......................... Passed 0.36 sec test 89 Start 89: key-MECI 89: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "MECI.mop" 89: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 89: Test timeout computed to be: 10000000 -76: -76: -76: MOPAC Job: "CdotAdotSdot.mop" ended normally on Jan 20, 2025, at 15:04. -76: -87: -87: -87: MOPAC Job: "INDO.mop" ended normally on Jan 20, 2025, at 15:04. -87: - 79/124 Test #87: key-INDO ......................... Passed 0.39 sec + 69/124 Test #75: key-BIRADICAL .................... Passed 0.92 sec test 90 Start 90: key-MNDO 90: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "MNDO.mop" 90: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 90: Test timeout computed to be: 10000000 -89: -89: -89: MOPAC Job: "MECI.mop" ended normally on Jan 20, 2025, at 15:04. -89: -89: WARNING: numerical heat mismatch between 8.74306 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.74262 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -89: WARNING: numerical mismatch between 36.58098 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.57911 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -88: -88: -88: MOPAC Job: "MAXCI.mop" ended normally on Jan 20, 2025, at 15:04. -88: - 80/124 Test #89: key-MECI ......................... Passed 0.37 sec +86: +86: +86: MOPAC Job: "EXTERNAL_2.mop" ended normally on Feb 23, 2026, at 23:29. +86: + 70/124 Test #86: key-EXTERNAL-2 ................... Passed 0.25 sec test 91 Start 91: key-MNDOD 91: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "MNDOD.mop" 91: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 91: Test timeout computed to be: 10000000 - 81/124 Test #76: key-CdotAdotSdot ................. Passed 3.31 sec +87: +87: +87: MOPAC Job: "INDO.mop" ended normally on Feb 23, 2026, at 23:29. +87: +88: +88: +88: MOPAC Job: "MAXCI.mop" ended normally on Feb 23, 2026, at 23:29. +88: +89: +89: +89: MOPAC Job: "MECI.mop" ended normally on Feb 23, 2026, at 23:29. +89: +89: WARNING: numerical heat mismatch between 8.74306 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.74262 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +89: WARNING: numerical mismatch between 36.58098 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.57911 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 71/124 Test #87: key-INDO ......................... Passed 0.28 sec test 92 Start 92: key-MRCI 92: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "MRCI.mop" 92: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 92: Test timeout computed to be: 10000000 - 82/124 Test #88: key-MAXCI ........................ Passed 0.46 sec + 72/124 Test #88: key-MAXCI ........................ Passed 0.28 sec test 93 Start 93: key-MS 93: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "MS.mop" 93: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 93: Test timeout computed to be: 10000000 -90: -90: -90: MOPAC Job: "MNDO.mop" ended normally on Jan 20, 2025, at 15:04. -90: -90: WARNING: numerical heat mismatch between -75.10973 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -75.11002 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -90: WARNING: numerical mismatch between -314.25912 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -314.26034 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 83/124 Test #90: key-MNDO ......................... Passed 0.40 sec + 73/124 Test #89: key-MECI ......................... Passed 0.26 sec test 94 Start 94: key-NOANCI 94: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "NOANCI.mop" 94: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 94: Test timeout computed to be: 10000000 -91: -91: -91: MOPAC Job: "MNDOD.mop" ended normally on Jan 20, 2025, at 15:04. -91: - 84/124 Test #91: key-MNDOD ........................ Passed 0.42 sec +90: +90: +90: MOPAC Job: "MNDO.mop" ended normally on Feb 23, 2026, at 23:29. +90: +90: WARNING: numerical heat mismatch between -75.10973 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -75.11002 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +90: WARNING: numerical mismatch between -314.25912 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -314.26034 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 74/124 Test #90: key-MNDO ......................... Passed 0.29 sec test 95 Start 95: key-NONET 95: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "NONET.mop" 95: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 95: Test timeout computed to be: 10000000 -93: -93: -93: MOPAC Job: "MS.mop" ended normally on Jan 20, 2025, at 15:04. -93: - 85/124 Test #93: key-MS ........................... Passed 0.47 sec +91: +91: +91: MOPAC Job: "MNDOD.mop" ended normally on Feb 23, 2026, at 23:29. +91: + 75/124 Test #91: key-MNDOD ........................ Passed 0.29 sec test 96 Start 96: key-NOSYM 96: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "NOSYM.mop" 96: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 96: Test timeout computed to be: 10000000 -92: -92: -92: MOPAC Job: "MRCI.mop" ended normally on Jan 20, 2025, at 15:04. -92: 94: 94: -94: MOPAC Job: "NOANCI.mop" ended normally on Jan 20, 2025, at 15:04. +94: MOPAC Job: "NOANCI.mop" ended normally on Feb 23, 2026, at 23:29. 94: +93: +93: +93: MOPAC Job: "MS.mop" ended normally on Feb 23, 2026, at 23:29. +93: 94: WARNING: numerical mismatch between 32.92723 on reference line 84 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.92687 on output line 84 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 94: WARNING: numerical mismatch between 32.92723 on reference line 236 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.92688 on output line 236 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 86/124 Test #92: key-MRCI ......................... Passed 0.64 sec + 76/124 Test #94: key-NOANCI ....................... Passed 0.26 sec test 97 Start 97: key-OCTET 97: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "OCTET.mop" 97: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 97: Test timeout computed to be: 10000000 - 87/124 Test #94: key-NOANCI ....................... Passed 0.40 sec + 77/124 Test #93: key-MS ........................... Passed 0.28 sec test 98 Start 98: key-OPEN @@ -3122,7 +3107,7 @@ 98: Test timeout computed to be: 10000000 95: 95: -95: MOPAC Job: "NONET.mop" ended normally on Jan 20, 2025, at 15:04. +95: MOPAC Job: "NONET.mop" ended normally on Feb 23, 2026, at 23:29. 95: 95: WARNING: numerical heat mismatch between 1889.18768 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1889.18921 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 95: WARNING: numerical mismatch between 7904.36124 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 7904.36764 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac @@ -3132,7 +3117,7 @@ 95: WARNING: numerical mismatch between 7904.36124 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 7904.36764 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 95: WARNING: numerical heat mismatch between 1889.18768 on reference line 536 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1889.18921 on output line 536 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 95: WARNING: numerical mismatch between 7904.36124 on reference line 536 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 7904.36764 on output line 536 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 88/124 Test #95: key-NONET ........................ Passed 0.45 sec + 78/124 Test #95: key-NONET ........................ Passed 0.33 sec test 99 Start 99: key-PECI @@ -3141,26 +3126,37 @@ 99: Test timeout computed to be: 10000000 96: 96: -96: MOPAC Job: "NOSYM.mop" ended normally on Jan 20, 2025, at 15:04. +96: MOPAC Job: "NOSYM.mop" ended normally on Feb 23, 2026, at 23:29. 96: 96: WARNING: numerical heat mismatch between -14.38448 on reference line 77 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -14.38481 on output line 77 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 96: WARNING: numerical mismatch between -60.18468 on reference line 77 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -60.18604 on output line 77 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 96: WARNING: numerical heat mismatch between -14.38448 on reference line 320 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -14.38481 on output line 320 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 96: WARNING: numerical mismatch between -60.18468 on reference line 320 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -60.18604 on output line 320 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 89/124 Test #96: key-NOSYM ........................ Passed 0.42 sec + 79/124 Test #96: key-NOSYM ........................ Passed 0.27 sec test 100 Start 100: key-PM3 100: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM3.mop" 100: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 100: Test timeout computed to be: 10000000 +92: +92: +92: MOPAC Job: "MRCI.mop" ended normally on Feb 23, 2026, at 23:29. +92: 97: 97: -97: MOPAC Job: "OCTET.mop" ended normally on Jan 20, 2025, at 15:04. +97: MOPAC Job: "OCTET.mop" ended normally on Feb 23, 2026, at 23:29. 97: + 80/124 Test #92: key-MRCI ......................... Passed 0.55 sec +test 101 + Start 101: key-PM6 + +101: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM6.mop" +101: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords +101: Test timeout computed to be: 10000000 98: 98: -98: MOPAC Job: "OPEN.mop" ended normally on Jan 20, 2025, at 15:04. +98: MOPAC Job: "OPEN.mop" ended normally on Feb 23, 2026, at 23:29. 98: 97: WARNING: numerical heat mismatch between 2654.15927 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2654.16139 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 97: WARNING: numerical mismatch between 11105.0024 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 11105.01124 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac @@ -3170,332 +3166,369 @@ 97: WARNING: numerical mismatch between 11105.0024 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 11105.01124 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 97: WARNING: numerical heat mismatch between 2654.15927 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2654.16139 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 97: WARNING: numerical mismatch between 11105.0024 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 11105.01124 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 90/124 Test #97: key-OCTET ........................ Passed 0.48 sec -test 101 - Start 101: key-PM6 - -101: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM6.mop" -101: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords -101: Test timeout computed to be: 10000000 -100: -100: -100: MOPAC Job: "PM3.mop" ended normally on Jan 20, 2025, at 15:04. -100: -100: WARNING: numerical heat mismatch between -85.0678 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -85.06811 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -100: WARNING: numerical mismatch between -355.92369 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -355.92497 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -98: WARNING: numerical mismatch between 1250.10713 on reference line 88 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1250.10688 on output line 88 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -98: WARNING: numerical mismatch between 1245.97296 on reference line 284 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1245.97271 on output line 284 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -98: WARNING: numerical mismatch between 1250.10713 on reference line 670 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1250.10688 on output line 670 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -98: WARNING: numerical mismatch between 1247.47435 on reference line 1042 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1247.4741 on output line 1042 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 91/124 Test #100: key-PM3 .......................... Passed 0.33 sec + 81/124 Test #97: key-OCTET ........................ Passed 0.33 sec test 102 Start 102: key-PM6-D3 102: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM6-D3.mop" 102: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 102: Test timeout computed to be: 10000000 - 92/124 Test #98: key-OPEN ......................... Passed 0.63 sec +99: +99: +99: MOPAC Job: "PECI.mop" ended normally on Feb 23, 2026, at 23:29. +99: +98: WARNING: numerical mismatch between 1250.10713 on reference line 88 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1250.10688 on output line 88 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +98: WARNING: numerical mismatch between 1245.97296 on reference line 284 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1245.97271 on output line 284 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +98: WARNING: numerical mismatch between 1250.10713 on reference line 670 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1250.10688 on output line 670 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +98: WARNING: numerical mismatch between 1247.47435 on reference line 1042 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1247.4741 on output line 1042 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 82/124 Test #98: key-OPEN ......................... Passed 0.37 sec test 103 Start 103: key-PM6-D3H4 103: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM6-D3H4.mop" 103: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 103: Test timeout computed to be: 10000000 -99: -99: -99: MOPAC Job: "PECI.mop" ended normally on Jan 20, 2025, at 15:04. -99: 99: WARNING: numerical heat mismatch between 7.84782 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 7.84737 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 99: WARNING: numerical mismatch between 32.83528 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.8334 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 99: WARNING: numerical heat mismatch between 8.61328 on reference line 401 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 8.61283 on output line 401 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 99: WARNING: numerical mismatch between 36.03795 on reference line 401 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 36.03607 on output line 401 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 93/124 Test #99: key-PECI ......................... Passed 0.69 sec + 83/124 Test #99: key-PECI ......................... Passed 0.30 sec test 104 Start 104: key-PM6-D3H4X 104: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM6-D3H4X.mop" 104: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 104: Test timeout computed to be: 10000000 -102: -102: -102: MOPAC Job: "PM6-D3.mop" ended normally on Jan 20, 2025, at 15:04. -102: -103: -103: -103: MOPAC Job: "PM6-D3H4.mop" ended normally on Jan 20, 2025, at 15:04. -103: +18: +18: +18: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_1C3W.mop" ended normally on Feb 23, 2026, at 23:29. +18: +19: +19: +19: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRX.mop" ended normally on Feb 23, 2026, at 23:29. +19: +17: +17: +17: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_2AT9.mop" ended normally on Feb 23, 2026, at 23:29. +17: +100: +100: +100: MOPAC Job: "PM3.mop" ended normally on Feb 23, 2026, at 23:29. +100: +100: WARNING: numerical heat mismatch between -85.0678 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -85.06811 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +100: WARNING: numerical mismatch between -355.92369 on reference line 81 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -355.92497 on output line 81 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 84/124 Test #19: pdb_compare4 ..................... Passed 1.84 sec + 85/124 Test #100: key-PM3 .......................... Passed 0.32 sec 101: 101: -101: MOPAC Job: "PM6.mop" ended normally on Jan 20, 2025, at 15:04. +101: MOPAC Job: "PM6.mop" ended normally on Feb 23, 2026, at 23:29. 101: -102: WARNING: numerical heat mismatch between -84.88111 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.88142 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -102: WARNING: numerical mismatch between -355.14258 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -355.14385 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -101: WARNING: numerical heat mismatch between -84.81192 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.81223 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -101: WARNING: numerical mismatch between -354.85309 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.85436 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -103: WARNING: numerical heat mismatch between -84.81306 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.81336 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -103: WARNING: numerical mismatch between -354.85784 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.85911 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 94/124 Test #102: key-PM6-D3 ....................... Passed 0.37 sec test 105 Start 105: key-PM6-DHplus 105: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM6-DHplus.mop" 105: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 105: Test timeout computed to be: 10000000 - 95/124 Test #101: key-PM6 .......................... Passed 0.52 sec test 106 Start 106: key-PM6-DH2 106: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM6-DH2.mop" 106: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 106: Test timeout computed to be: 10000000 - 96/124 Test #103: key-PM6-D3H4 ..................... Passed 0.38 sec +101: WARNING: numerical heat mismatch between -84.81192 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.81223 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +101: WARNING: numerical mismatch between -354.85309 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.85436 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +20: +20: +20: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_1BRR.mop" ended normally on Feb 23, 2026, at 23:29. +20: + 86/124 Test #101: key-PM6 .......................... Passed 0.28 sec test 107 Start 107: key-PM6-DH2X 107: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM6-DH2X.mop" 107: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 107: Test timeout computed to be: 10000000 -104: -104: -104: MOPAC Job: "PM6-D3H4X.mop" ended normally on Jan 20, 2025, at 15:04. -104: -104: WARNING: numerical heat mismatch between -84.81306 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.81336 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -104: WARNING: numerical mismatch between -354.85784 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.85911 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 97/124 Test #104: key-PM6-D3H4X .................... Passed 0.40 sec +102: +102: +102: MOPAC Job: "PM6-D3.mop" ended normally on Feb 23, 2026, at 23:29. +102: + 87/124 Test #18: pdb_compare3 ..................... Passed 1.91 sec test 108 Start 108: key-PM7 108: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM7.mop" 108: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 108: Test timeout computed to be: 10000000 -105: -105: -105: MOPAC Job: "PM6-DHplus.mop" ended normally on Jan 20, 2025, at 15:04. -105: -105: WARNING: numerical heat mismatch between -84.81729 on reference line 87 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.8176 on output line 87 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -105: WARNING: numerical mismatch between -354.87556 on reference line 87 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.87683 on output line 87 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac - 98/124 Test #105: key-PM6-DHplus ................... Passed 0.34 sec +102: WARNING: numerical heat mismatch between -84.88111 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.88142 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +102: WARNING: numerical mismatch between -355.14258 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -355.14385 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 88/124 Test #17: pdb_compare2 ..................... Passed 1.93 sec test 109 Start 109: key-PM7-TS 109: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "PM7-TS.mop" 109: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 109: Test timeout computed to be: 10000000 -107: -107: -107: MOPAC Job: "PM6-DH2X.mop" ended normally on Jan 20, 2025, at 15:04. -107: -107: WARNING: numerical heat mismatch between -84.81729 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.8176 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -107: WARNING: numerical mismatch between -354.87556 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.87683 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -106: -106: -106: MOPAC Job: "PM6-DH2.mop" ended normally on Jan 20, 2025, at 15:04. -106: - 99/124 Test #107: key-PM6-DH2X ..................... Passed 0.43 sec +76: +76: +76: MOPAC Job: "CdotAdotSdot.mop" ended normally on Feb 23, 2026, at 23:29. +76: +103: +103: +103: MOPAC Job: "PM6-D3H4.mop" ended normally on Feb 23, 2026, at 23:29. +103: + 89/124 Test #102: key-PM6-D3 ....................... Passed 0.27 sec test 110 Start 110: key-QUARTET 110: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "QUARTET.mop" 110: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 110: Test timeout computed to be: 10000000 -106: WARNING: numerical heat mismatch between -84.81729 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.8176 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -106: WARNING: numerical mismatch between -354.87556 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.87683 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -100/124 Test #106: key-PM6-DH2 ...................... Passed 0.59 sec +103: WARNING: numerical heat mismatch between -84.81306 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.81336 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +103: WARNING: numerical mismatch between -354.85784 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.85911 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 90/124 Test #103: key-PM6-D3H4 ..................... Passed 0.25 sec test 111 Start 111: key-QUINTET 111: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "QUINTET.mop" 111: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 111: Test timeout computed to be: 10000000 -109: -109: -109: MOPAC Job: "PM7-TS.mop" ended normally on Jan 20, 2025, at 15:04. -109: -109: WARNING: numerical heat mismatch between -40.84667 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -40.84694 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -109: WARNING: numerical mismatch between -170.90245 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -170.90361 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -101/124 Test #109: key-PM7-TS ....................... Passed 0.35 sec +104: +104: +104: MOPAC Job: "PM6-D3H4X.mop" ended normally on Feb 23, 2026, at 23:29. +104: + 91/124 Test #20: pdb_compare5 ..................... Passed 1.93 sec test 112 Start 112: key-RHF 112: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "RHF.mop" 112: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 112: Test timeout computed to be: 10000000 -108: -108: -108: MOPAC Job: "PM7.mop" ended normally on Jan 20, 2025, at 15:04. -108: -110: -110: -110: MOPAC Job: "QUARTET.mop" ended normally on Jan 20, 2025, at 15:04. -110: -108: WARNING: numerical heat mismatch between -84.51541 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51572 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -108: WARNING: numerical mismatch between -353.61248 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61376 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110: WARNING: numerical heat mismatch between 126.90707 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 126.90725 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110: WARNING: numerical mismatch between 530.97919 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 530.97994 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110: WARNING: numerical heat mismatch between 126.90707 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 126.90725 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110: WARNING: numerical mismatch between 530.97919 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 530.97994 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110: WARNING: numerical heat mismatch between 125.20262 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 125.20272 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110: WARNING: numerical mismatch between 523.84776 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 523.84819 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110: WARNING: numerical heat mismatch between 125.20262 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 125.20272 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110: WARNING: numerical mismatch between 523.84776 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 523.84819 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -102/124 Test #110: key-QUARTET ...................... Passed 0.48 sec +104: WARNING: numerical heat mismatch between -84.81306 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.81336 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +104: WARNING: numerical mismatch between -354.85784 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.85911 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 92/124 Test #76: key-CdotAdotSdot ................. Passed 2.10 sec test 113 Start 113: key-RM1 113: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "RM1.mop" 113: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 113: Test timeout computed to be: 10000000 -103/124 Test #108: key-PM7 .......................... Passed 0.68 sec + 93/124 Test #104: key-PM6-D3H4X .................... Passed 0.28 sec test 114 Start 114: key-ROOT 114: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "ROOT.mop" 114: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 114: Test timeout computed to be: 10000000 -21: -21: -21: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_1AT9.mop" ended normally on Jan 20, 2025, at 15:04. -21: -111: -111: -111: MOPAC Job: "QUINTET.mop" ended normally on Jan 20, 2025, at 15:04. -111: -112: -112: -112: MOPAC Job: "RHF.mop" ended normally on Jan 20, 2025, at 15:04. -112: -112: WARNING: numerical heat mismatch between -61.93555 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -61.93566 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -112: WARNING: numerical mismatch between -259.13834 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -259.1388 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -112: WARNING: numerical mismatch between 32.92723 on reference line 230 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.92687 on output line 230 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -104/124 Test #112: key-RHF .......................... Passed 0.40 sec +105: +105: +105: MOPAC Job: "PM6-DHplus.mop" ended normally on Feb 23, 2026, at 23:29. +105: +105: WARNING: numerical heat mismatch between -84.81729 on reference line 87 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.8176 on output line 87 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +105: WARNING: numerical mismatch between -354.87556 on reference line 87 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.87683 on output line 87 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +107: +107: +107: MOPAC Job: "PM6-DH2X.mop" ended normally on Feb 23, 2026, at 23:29. +107: +106: +106: +106: MOPAC Job: "PM6-DH2.mop" ended normally on Feb 23, 2026, at 23:29. +106: +107: WARNING: numerical heat mismatch between -84.81729 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.8176 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +107: WARNING: numerical mismatch between -354.87556 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.87683 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 94/124 Test #105: key-PM6-DHplus ................... Passed 0.26 sec test 115 Start 115: key-SEPTET 115: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "SEPTET.mop" 115: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 115: Test timeout computed to be: 10000000 -111: WARNING: numerical heat mismatch between 704.89987 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 704.90046 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -111: WARNING: numerical mismatch between 2949.30106 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2949.30352 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -111: WARNING: numerical heat mismatch between 704.89987 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 704.90046 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -111: WARNING: numerical mismatch between 2949.30106 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2949.30352 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -111: WARNING: numerical heat mismatch between 708.35733 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 708.35793 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -111: WARNING: numerical mismatch between 2963.76706 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2963.76957 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -111: WARNING: numerical heat mismatch between 708.35733 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 708.35793 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -111: WARNING: numerical mismatch between 2963.76706 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2963.76957 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -105/124 Test #111: key-QUINTET ...................... Passed 0.53 sec +106: WARNING: numerical heat mismatch between -84.81729 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.8176 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +106: WARNING: numerical mismatch between -354.87556 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -354.87683 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 95/124 Test #107: key-PM6-DH2X ..................... Passed 0.24 sec test 116 Start 116: key-SEXTET 116: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "SEXTET.mop" 116: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 116: Test timeout computed to be: 10000000 -106/124 Test #21: pdb_compare6 ..................... Passed 15.20 sec +108: +108: +108: MOPAC Job: "PM7.mop" ended normally on Feb 23, 2026, at 23:29. +108: +108: WARNING: numerical heat mismatch between -84.51541 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -84.51572 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +108: WARNING: numerical mismatch between -353.61248 on reference line 82 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -353.61376 on output line 82 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 96/124 Test #106: key-PM6-DH2 ...................... Passed 0.28 sec test 117 Start 117: key-SINGLET 117: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "SINGLET.mop" 117: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 117: Test timeout computed to be: 10000000 -113: -113: -113: MOPAC Job: "RM1.mop" ended normally on Jan 20, 2025, at 15:04. -113: -113: WARNING: numerical heat mismatch between -81.55398 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -81.55429 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -113: WARNING: numerical mismatch between -341.22185 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -341.22315 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -107/124 Test #113: key-RM1 .......................... Passed 0.35 sec +109: +109: +109: MOPAC Job: "PM7-TS.mop" ended normally on Feb 23, 2026, at 23:29. +109: +109: WARNING: numerical heat mismatch between -40.84667 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -40.84694 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +109: WARNING: numerical mismatch between -170.90245 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -170.90361 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +110: +110: +110: MOPAC Job: "QUARTET.mop" ended normally on Feb 23, 2026, at 23:29. +110: + 97/124 Test #108: key-PM7 .......................... Passed 0.26 sec test 118 Start 118: key-SNAP 118: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "SNAP.mop" 118: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 118: Test timeout computed to be: 10000000 -115: -115: -115: MOPAC Job: "SEPTET.mop" ended normally on Jan 20, 2025, at 15:04. -115: -117: -117: -117: MOPAC Job: "SINGLET.mop" ended normally on Jan 20, 2025, at 15:04. -117: -117: WARNING: numerical mismatch between -35.54835 on reference line 85 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -35.54877 on output line 85 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -117: WARNING: numerical mismatch between 59.76507 on reference line 273 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 59.76473 on output line 273 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -108/124 Test #117: key-SINGLET ...................... Passed 0.45 sec +112: +112: +112: MOPAC Job: "RHF.mop" ended normally on Feb 23, 2026, at 23:29. +112: + 98/124 Test #109: key-PM7-TS ....................... Passed 0.27 sec test 119 Start 119: key-SYMMETRY 119: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "SYMMETRY.mop" 119: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 119: Test timeout computed to be: 10000000 -115: WARNING: numerical heat mismatch between 1293.36484 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1293.3659 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -115: WARNING: numerical mismatch between 5411.43848 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5411.44291 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -115: WARNING: numerical heat mismatch between 1293.36484 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1293.3659 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -115: WARNING: numerical mismatch between 5411.43848 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5411.44291 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -115: WARNING: numerical heat mismatch between 1298.14481 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1298.14588 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -115: WARNING: numerical mismatch between 5431.4379 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5431.44236 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -115: WARNING: numerical heat mismatch between 1298.14481 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1298.14588 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -115: WARNING: numerical mismatch between 5431.4379 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5431.44236 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: -116: -116: MOPAC Job: "SEXTET.mop" ended normally on Jan 20, 2025, at 15:04. -116: -118: -118: -118: MOPAC Job: "SNAP.mop" ended normally on Jan 20, 2025, at 15:04. -118: -109/124 Test #115: key-SEPTET ....................... Passed 0.62 sec +112: WARNING: numerical heat mismatch between -61.93555 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -61.93566 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +112: WARNING: numerical mismatch between -259.13834 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -259.1388 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +112: WARNING: numerical mismatch between 32.92723 on reference line 230 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 32.92687 on output line 230 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac + 99/124 Test #112: key-RHF .......................... Passed 0.24 sec test 120 Start 120: key-TDIP 120: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "TDIP.mop" 120: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 120: Test timeout computed to be: 10000000 -118: WARNING: numerical heat mismatch between -14.37282 on reference line 75 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -14.37315 on output line 75 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -118: WARNING: numerical mismatch between -60.13588 on reference line 75 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -60.13724 on output line 75 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -118: WARNING: numerical heat mismatch between -14.37287 on reference line 227 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -14.3732 on output line 227 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -118: WARNING: numerical mismatch between -60.13611 on reference line 227 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -60.13747 on output line 227 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -118: WARNING: numerical heat mismatch between -14.37287 on reference line 378 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -14.3732 on output line 378 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -118: WARNING: numerical mismatch between -60.13611 on reference line 378 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -60.13747 on output line 378 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: WARNING: numerical heat mismatch between 1352.10281 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1352.10392 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: WARNING: numerical mismatch between 5657.19815 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5657.2028 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: WARNING: numerical heat mismatch between 1352.10281 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1352.10392 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: WARNING: numerical mismatch between 5657.19815 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5657.2028 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: WARNING: numerical heat mismatch between 1352.1869 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1352.18802 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: WARNING: numerical mismatch between 5657.55001 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5657.55466 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: WARNING: numerical heat mismatch between 1352.1869 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1352.18802 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -116: WARNING: numerical mismatch between 5657.55001 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5657.55466 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -110/124 Test #118: key-SNAP ......................... Passed 0.48 sec +59: +59: +59: MOPAC Job: "poly_c8.mop" ended normally on Feb 23, 2026, at 23:29. +59: +110: WARNING: numerical heat mismatch between 126.90707 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 126.90725 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +110: WARNING: numerical mismatch between 530.97919 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 530.97994 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +110: WARNING: numerical heat mismatch between 126.90707 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 126.90725 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +110: WARNING: numerical mismatch between 530.97919 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 530.97994 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +110: WARNING: numerical heat mismatch between 125.20262 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 125.20272 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +110: WARNING: numerical mismatch between 523.84776 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 523.84819 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +110: WARNING: numerical heat mismatch between 125.20262 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 125.20272 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +110: WARNING: numerical mismatch between 523.84776 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 523.84819 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +113: +113: +113: MOPAC Job: "RM1.mop" ended normally on Feb 23, 2026, at 23:29. +113: +111: +111: +111: MOPAC Job: "QUINTET.mop" ended normally on Feb 23, 2026, at 23:29. +111: +113: WARNING: numerical heat mismatch between -81.55398 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -81.55429 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +113: WARNING: numerical mismatch between -341.22185 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -341.22315 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +100/124 Test #113: key-RM1 .......................... Passed 0.27 sec test 121 Start 121: key-TRIPLET 121: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "TRIPLET.mop" 121: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 121: Test timeout computed to be: 10000000 -111/124 Test #116: key-SEXTET ....................... Passed 0.65 sec +101/124 Test #110: key-QUARTET ...................... Passed 0.36 sec test 122 Start 122: key-UHF 122: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "UHF.mop" 122: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 122: Test timeout computed to be: 10000000 -120: -120: -120: MOPAC Job: "TDIP.mop" ended normally on Jan 20, 2025, at 15:04. -120: -112/124 Test #120: key-TDIP ......................... Passed 0.38 sec +111: WARNING: numerical heat mismatch between 704.89987 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 704.90046 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +111: WARNING: numerical mismatch between 2949.30106 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2949.30352 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +111: WARNING: numerical heat mismatch between 704.89987 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 704.90046 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +111: WARNING: numerical mismatch between 2949.30106 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2949.30352 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +111: WARNING: numerical heat mismatch between 708.35733 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 708.35793 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +111: WARNING: numerical mismatch between 2963.76706 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2963.76957 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +111: WARNING: numerical heat mismatch between 708.35733 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 708.35793 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +111: WARNING: numerical mismatch between 2963.76706 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 2963.76957 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +102/124 Test #111: key-QUINTET ...................... Passed 0.36 sec test 123 Start 123: key-WRTCI 123: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "WRTCI.mop" 123: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords 123: Test timeout computed to be: 10000000 -121: -121: -121: MOPAC Job: "TRIPLET.mop" ended normally on Jan 20, 2025, at 15:04. -121: +103/124 Test #59: poly_c8 .......................... Passed 2.89 sec +test 124 + Start 124: key-WRTCONF + +124: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "WRTCONF.mop" +124: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords +124: Test timeout computed to be: 10000000 +117: +117: +117: MOPAC Job: "SINGLET.mop" ended normally on Feb 23, 2026, at 23:29. +117: +118: +118: +118: MOPAC Job: "SNAP.mop" ended normally on Feb 23, 2026, at 23:29. +118: +117: WARNING: numerical mismatch between -35.54835 on reference line 85 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -35.54877 on output line 85 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +117: WARNING: numerical mismatch between 59.76507 on reference line 273 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 59.76473 on output line 273 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +120: +120: +120: MOPAC Job: "TDIP.mop" ended normally on Feb 23, 2026, at 23:29. +120: +104/124 Test #117: key-SINGLET ...................... Passed 0.29 sec +118: WARNING: numerical heat mismatch between -14.37282 on reference line 75 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -14.37315 on output line 75 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +118: WARNING: numerical mismatch between -60.13588 on reference line 75 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -60.13724 on output line 75 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +118: WARNING: numerical heat mismatch between -14.37287 on reference line 227 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -14.3732 on output line 227 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +118: WARNING: numerical mismatch between -60.13611 on reference line 227 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -60.13747 on output line 227 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +118: WARNING: numerical heat mismatch between -14.37287 on reference line 378 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -14.3732 on output line 378 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +118: WARNING: numerical mismatch between -60.13611 on reference line 378 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -60.13747 on output line 378 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +105/124 Test #120: key-TDIP ......................... Passed 0.24 sec +115: +115: +115: MOPAC Job: "SEPTET.mop" ended normally on Feb 23, 2026, at 23:29. +115: +116: +116: +116: MOPAC Job: "SEXTET.mop" ended normally on Feb 23, 2026, at 23:29. +116: +106/124 Test #118: key-SNAP ......................... Passed 0.31 sec +115: WARNING: numerical heat mismatch between 1293.36484 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1293.3659 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +115: WARNING: numerical mismatch between 5411.43848 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5411.44291 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +115: WARNING: numerical heat mismatch between 1293.36484 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1293.3659 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +115: WARNING: numerical mismatch between 5411.43848 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5411.44291 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +115: WARNING: numerical heat mismatch between 1298.14481 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1298.14588 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +115: WARNING: numerical mismatch between 5431.4379 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5431.44236 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +115: WARNING: numerical heat mismatch between 1298.14481 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1298.14588 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +115: WARNING: numerical mismatch between 5431.4379 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5431.44236 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +122: +122: +122: MOPAC Job: "UHF.mop" ended normally on Feb 23, 2026, at 23:29. +122: +116: WARNING: numerical heat mismatch between 1352.10281 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1352.10392 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +116: WARNING: numerical mismatch between 5657.19815 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5657.2028 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +116: WARNING: numerical heat mismatch between 1352.10281 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1352.10392 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +116: WARNING: numerical mismatch between 5657.19815 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5657.2028 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +116: WARNING: numerical heat mismatch between 1352.1869 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1352.18802 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +116: WARNING: numerical mismatch between 5657.55001 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5657.55466 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +116: WARNING: numerical heat mismatch between 1352.1869 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 1352.18802 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +116: WARNING: numerical mismatch between 5657.55001 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 5657.55466 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 119: 119: -119: MOPAC Job: "SYMMETRY.mop" ended normally on Jan 20, 2025, at 15:04. +119: MOPAC Job: "SYMMETRY.mop" ended normally on Feb 23, 2026, at 23:29. 119: +107/124 Test #115: key-SEPTET ....................... Passed 0.41 sec +121: +121: +121: MOPAC Job: "TRIPLET.mop" ended normally on Feb 23, 2026, at 23:29. +121: +122: WARNING: numerical heat mismatch between -61.93555 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -61.93566 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +122: WARNING: numerical mismatch between -259.13836 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -259.13882 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +122: WARNING: numerical mismatch between 30.36323 on reference line 244 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 30.36287 on output line 244 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +108/124 Test #116: key-SEXTET ....................... Passed 0.40 sec +124: +124: +124: MOPAC Job: "WRTCONF.mop" ended normally on Feb 23, 2026, at 23:29. +124: +109/124 Test #122: key-UHF .......................... Passed 0.25 sec 121: WARNING: numerical heat mismatch between 93.14412 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 93.14423 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 121: WARNING: numerical mismatch between 389.71498 on reference line 73 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 389.71545 on output line 73 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 121: WARNING: numerical heat mismatch between 93.14412 on reference line 222 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 93.14423 on output line 222 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac @@ -3504,17 +3537,6 @@ 121: WARNING: numerical mismatch between 393.55788 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 393.55834 on output line 374 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 121: WARNING: numerical heat mismatch between 94.06259 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 94.0627 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 121: WARNING: numerical mismatch between 393.55788 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 393.55834 on output line 535 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -122: -122: -122: MOPAC Job: "UHF.mop" ended normally on Jan 20, 2025, at 15:04. -122: -113/124 Test #121: key-TRIPLET ...................... Passed 0.42 sec -test 124 - Start 124: key-WRTCONF - -124: Test command: /usr/bin/python3 "/build/reproducible-path/mopac-23.0.3/tests/run_test.py" "/build/reproducible-path/mopac-23.0.3/tests/keywords" "/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac" "0.01" "WRTCONF.mop" -124: Working Directory: /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/tests/keywords -124: Test timeout computed to be: 10000000 119: WARNING: numerical heat mismatch between 16.84931 on reference line 98 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 16.84886 on output line 98 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 119: WARNING: numerical mismatch between 70.49749 on reference line 98 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 70.49565 on output line 98 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 119: WARNING: numerical heat mismatch between 13.85544 on reference line 293 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 13.855 on output line 293 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac @@ -3525,425 +3547,392 @@ 119: WARNING: numerical mismatch between 280.41882 on reference line 637 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 280.41805 on output line 637 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 119: WARNING: numerical heat mismatch between 66.85441 on reference line 805 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 66.85422 on output line 805 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 119: WARNING: numerical mismatch between 279.71884 on reference line 805 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 279.71807 on output line 805 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -122: WARNING: numerical heat mismatch between -61.93555 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -61.93566 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -122: WARNING: numerical mismatch between -259.13836 on reference line 80 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -259.13882 on output line 80 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -122: WARNING: numerical mismatch between 30.36323 on reference line 244 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 30.36287 on output line 244 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114/124 Test #119: key-SYMMETRY ..................... Passed 0.64 sec -115/124 Test #122: key-UHF .......................... Passed 0.50 sec +110/124 Test #124: key-WRTCONF ...................... Passed 0.22 sec 123: 123: -123: MOPAC Job: "WRTCI.mop" ended normally on Jan 20, 2025, at 15:04. +123: MOPAC Job: "WRTCI.mop" ended normally on Feb 23, 2026, at 23:29. 123: -116/124 Test #123: key-WRTCI ........................ Passed 0.37 sec -124: -124: -124: MOPAC Job: "WRTCONF.mop" ended normally on Jan 20, 2025, at 15:04. -124: -117/124 Test #124: key-WRTCONF ...................... Passed 0.36 sec -27: -27: -27: MOPAC Job: "erratic1.mop" ended normally on Jan 20, 2025, at 15:04. -27: -27: WARNING: numerical heat mismatch between -167.66206 on reference line 360 in /build/reproducible-path/mopac-23.0.3/tests and -167.67858 on output line 394 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -701.49806 on reference line 360 in /build/reproducible-path/mopac-23.0.3/tests and -701.56717 on output line 394 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -62312.34782 on reference line 362 in /build/reproducible-path/mopac-23.0.3/tests and -62312.35862 on output line 396 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -160.75863 on reference line 364 in /build/reproducible-path/mopac-23.0.3/tests and -160.76943 on output line 398 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -5.57884 on reference line 365 in /build/reproducible-path/mopac-23.0.3/tests and -5.57835 on output line 399 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.32459 on reference line 366 in /build/reproducible-path/mopac-23.0.3/tests and -1.3308 on output line 400 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -167.66206 on reference line 367 in /build/reproducible-path/mopac-23.0.3/tests and -167.67858 on output line 401 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2702.11915 on reference line 372 in /build/reproducible-path/mopac-23.0.3/tests and -2702.11961 on output line 406 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -16549.96563 on reference line 373 in /build/reproducible-path/mopac-23.0.3/tests and -16547.8535 on output line 407 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 13847.84648 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests and 13845.73388 on output line 408 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 230.06 on reference line 375 in /build/reproducible-path/mopac-23.0.3/tests and 230.32 on output line 409 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 254.54 on reference line 376 in /build/reproducible-path/mopac-23.0.3/tests and 254.73 on output line 410 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 8.208041 on reference line 379 in /build/reproducible-path/mopac-23.0.3/tests and 8.208688 on output line 413 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -8.208 on reference line 380 in /build/reproducible-path/mopac-23.0.3/tests and -8.209 on output line 414 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.59953271 on reference line 403 in /build/reproducible-path/mopac-23.0.3/tests and -2.60458988 on output line 437 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.77575526 on reference line 403 in /build/reproducible-path/mopac-23.0.3/tests and -2.77222093 on output line 437 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.41403348 on reference line 403 in /build/reproducible-path/mopac-23.0.3/tests and -0.41116643 on output line 437 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.87686704 on reference line 404 in /build/reproducible-path/mopac-23.0.3/tests and -1.87296927 on output line 438 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.57709686 on reference line 404 in /build/reproducible-path/mopac-23.0.3/tests and -1.57869064 on output line 438 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.11334803 on reference line 404 in /build/reproducible-path/mopac-23.0.3/tests and 0.11524094 on output line 438 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.40333884 on reference line 405 in /build/reproducible-path/mopac-23.0.3/tests and -1.4021531 on output line 439 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.27574228 on reference line 405 in /build/reproducible-path/mopac-23.0.3/tests and 1.2781737 on output line 439 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.60327578 on reference line 406 in /build/reproducible-path/mopac-23.0.3/tests and -1.59123451 on output line 440 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.71421711 on reference line 406 in /build/reproducible-path/mopac-23.0.3/tests and -0.72028295 on output line 440 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.89666343 on reference line 407 in /build/reproducible-path/mopac-23.0.3/tests and -0.89226072 on output line 441 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.54570105 on reference line 407 in /build/reproducible-path/mopac-23.0.3/tests and 0.54373444 on output line 441 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.52366121 on reference line 407 in /build/reproducible-path/mopac-23.0.3/tests and -0.5227868 on output line 441 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.39949204 on reference line 408 in /build/reproducible-path/mopac-23.0.3/tests and -1.40279144 on output line 442 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.43423735 on reference line 408 in /build/reproducible-path/mopac-23.0.3/tests and 1.43194696 on output line 442 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.68105693 on reference line 408 in /build/reproducible-path/mopac-23.0.3/tests and -1.67687481 on output line 442 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.00548105 on reference line 409 in /build/reproducible-path/mopac-23.0.3/tests and -1.01975438 on output line 443 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.87491828 on reference line 409 in /build/reproducible-path/mopac-23.0.3/tests and 2.87503298 on output line 443 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.49999724 on reference line 409 in /build/reproducible-path/mopac-23.0.3/tests and -1.49133531 on output line 443 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.27371739 on reference line 410 in /build/reproducible-path/mopac-23.0.3/tests and 0.25616123 on output line 444 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.11422137 on reference line 410 in /build/reproducible-path/mopac-23.0.3/tests and 3.12294586 on output line 444 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.13548835 on reference line 410 in /build/reproducible-path/mopac-23.0.3/tests and -1.12126254 on output line 444 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.73362283 on reference line 411 in /build/reproducible-path/mopac-23.0.3/tests and -1.75416954 on output line 445 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.81609528 on reference line 411 in /build/reproducible-path/mopac-23.0.3/tests and 3.81118124 on output line 445 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.67831486 on reference line 411 in /build/reproducible-path/mopac-23.0.3/tests and -1.6703825 on output line 445 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.5358667 on reference line 412 in /build/reproducible-path/mopac-23.0.3/tests and 0.54130791 on output line 446 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.35294005 on reference line 412 in /build/reproducible-path/mopac-23.0.3/tests and 0.35964566 on output line 446 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.54430006 on reference line 412 in /build/reproducible-path/mopac-23.0.3/tests and -0.54757691 on output line 446 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.33584851 on reference line 413 in /build/reproducible-path/mopac-23.0.3/tests and 1.34353455 on output line 447 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.10823064 on reference line 413 in /build/reproducible-path/mopac-23.0.3/tests and 0.10801867 on output line 447 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.61785947 on reference line 413 in /build/reproducible-path/mopac-23.0.3/tests and 0.61158494 on output line 447 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.57486784 on reference line 414 in /build/reproducible-path/mopac-23.0.3/tests and 1.57974885 on output line 448 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.37112909 on reference line 414 in /build/reproducible-path/mopac-23.0.3/tests and -1.3727715 on output line 448 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.81847858 on reference line 414 in /build/reproducible-path/mopac-23.0.3/tests and 0.80475928 on output line 448 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.68336068 on reference line 415 in /build/reproducible-path/mopac-23.0.3/tests and 2.6917863 on output line 449 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.76935628 on reference line 415 in /build/reproducible-path/mopac-23.0.3/tests and 0.76741373 on output line 449 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.4261294 on reference line 415 in /build/reproducible-path/mopac-23.0.3/tests and 0.41987378 on output line 449 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.73060349 on reference line 416 in /build/reproducible-path/mopac-23.0.3/tests and 0.74181967 on output line 450 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.661907 on reference line 416 in /build/reproducible-path/mopac-23.0.3/tests and 0.65715347 on output line 450 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.877465 on reference line 416 in /build/reproducible-path/mopac-23.0.3/tests and 1.87489652 on output line 450 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.83813135 on reference line 417 in /build/reproducible-path/mopac-23.0.3/tests and -2.50328394 on output line 451 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.68231128 on reference line 417 in /build/reproducible-path/mopac-23.0.3/tests and -2.87426345 on output line 451 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.48424696 on reference line 417 in /build/reproducible-path/mopac-23.0.3/tests and -1.50197317 on output line 451 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.99139435 on reference line 418 in /build/reproducible-path/mopac-23.0.3/tests and -2.23719431 on output line 452 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -3.68192697 on reference line 418 in /build/reproducible-path/mopac-23.0.3/tests and -3.69457777 on output line 452 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.28044258 on reference line 418 in /build/reproducible-path/mopac-23.0.3/tests and 0.0607513 on output line 452 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -3.54098093 on reference line 419 in /build/reproducible-path/mopac-23.0.3/tests and -3.67884937 on output line 453 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.92814342 on reference line 419 in /build/reproducible-path/mopac-23.0.3/tests and -2.69066652 on output line 453 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.13597889 on reference line 419 in /build/reproducible-path/mopac-23.0.3/tests and -0.18203522 on output line 453 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.32611074 on reference line 420 in /build/reproducible-path/mopac-23.0.3/tests and -1.32092384 on output line 454 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.88447283 on reference line 420 in /build/reproducible-path/mopac-23.0.3/tests and 0.87822728 on output line 454 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.44505802 on reference line 420 in /build/reproducible-path/mopac-23.0.3/tests and 0.44781147 on output line 454 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.00536182 on reference line 421 in /build/reproducible-path/mopac-23.0.3/tests and -1.00657457 on output line 455 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.05545018 on reference line 421 in /build/reproducible-path/mopac-23.0.3/tests and 1.05947546 on output line 455 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.6473519 on reference line 421 in /build/reproducible-path/mopac-23.0.3/tests and -2.64477517 on output line 455 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.50472859 on reference line 422 in /build/reproducible-path/mopac-23.0.3/tests and -2.50739036 on output line 456 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.35261396 on reference line 422 in /build/reproducible-path/mopac-23.0.3/tests and 1.3419762 on output line 456 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.76714801 on reference line 422 in /build/reproducible-path/mopac-23.0.3/tests and -1.76262974 on output line 456 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.98517326 on reference line 423 in /build/reproducible-path/mopac-23.0.3/tests and 0.99079539 on output line 457 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.07758771 on reference line 423 in /build/reproducible-path/mopac-23.0.3/tests and 0.09433736 on output line 457 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.48015972 on reference line 423 in /build/reproducible-path/mopac-23.0.3/tests and -1.4862362 on output line 457 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.79430531 on reference line 424 in /build/reproducible-path/mopac-23.0.3/tests and 0.783148 on output line 458 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.2693865 on reference line 424 in /build/reproducible-path/mopac-23.0.3/tests and 2.28164716 on output line 458 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.9369799 on reference line 424 in /build/reproducible-path/mopac-23.0.3/tests and -0.92451608 on output line 458 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.25653234 on reference line 425 in /build/reproducible-path/mopac-23.0.3/tests and 2.26308405 on output line 459 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.56734258 on reference line 425 in /build/reproducible-path/mopac-23.0.3/tests and -1.57448505 on output line 459 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.65451787 on reference line 425 in /build/reproducible-path/mopac-23.0.3/tests and 1.63806366 on output line 459 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.6120327 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests and 0.616268 on output line 460 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.87739345 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests and -1.87791738 on output line 460 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.02629055 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests and 1.0122186 on output line 460 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.98131316 on reference line 427 in /build/reproducible-path/mopac-23.0.3/tests and 1.98261565 on output line 461 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.81923007 on reference line 427 in /build/reproducible-path/mopac-23.0.3/tests and -1.81751169 on output line 461 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.10064983 on reference line 427 in /build/reproducible-path/mopac-23.0.3/tests and -0.11761717 on output line 461 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.34816329 on reference line 428 in /build/reproducible-path/mopac-23.0.3/tests and 3.35745006 on output line 462 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.58505225 on reference line 428 in /build/reproducible-path/mopac-23.0.3/tests and 0.57956035 on output line 462 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.28076405 on reference line 428 in /build/reproducible-path/mopac-23.0.3/tests and 1.27308415 on output line 462 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.16963 on reference line 429 in /build/reproducible-path/mopac-23.0.3/tests and 3.17627974 on output line 463 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.3926988 on reference line 429 in /build/reproducible-path/mopac-23.0.3/tests and 0.39253518 on output line 463 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.48857036 on reference line 429 in /build/reproducible-path/mopac-23.0.3/tests and -0.49651733 on output line 463 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.55662468 on reference line 430 in /build/reproducible-path/mopac-23.0.3/tests and 2.56665193 on output line 464 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.85992671 on reference line 430 in /build/reproducible-path/mopac-23.0.3/tests and 1.85847494 on output line 464 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.30372863 on reference line 430 in /build/reproducible-path/mopac-23.0.3/tests and 0.30059768 on output line 464 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.49054429 on reference line 431 in /build/reproducible-path/mopac-23.0.3/tests and 0.50193171 on output line 465 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.73219412 on reference line 431 in /build/reproducible-path/mopac-23.0.3/tests and 1.72799961 on output line 465 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.75442162 on reference line 431 in /build/reproducible-path/mopac-23.0.3/tests and 1.75650557 on output line 465 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.21695551 on reference line 432 in /build/reproducible-path/mopac-23.0.3/tests and -0.20547007 on output line 466 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.130312 on reference line 432 in /build/reproducible-path/mopac-23.0.3/tests and 0.12527497 on output line 466 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.11828049 on reference line 432 in /build/reproducible-path/mopac-23.0.3/tests and 2.11611979 on output line 466 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.40601706 on reference line 433 in /build/reproducible-path/mopac-23.0.3/tests and 1.41931707 on output line 467 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.54294822 on reference line 433 in /build/reproducible-path/mopac-23.0.3/tests and 0.53449821 on output line 467 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.7354817 on reference line 433 in /build/reproducible-path/mopac-23.0.3/tests and 2.73072526 on output line 467 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.599532711 on reference line 437 in /build/reproducible-path/mopac-23.0.3/tests and -2.60458988 on output line 471 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.775755262 on reference line 437 in /build/reproducible-path/mopac-23.0.3/tests and -2.772220928 on output line 471 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.414033476 on reference line 437 in /build/reproducible-path/mopac-23.0.3/tests and -0.411166427 on output line 471 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.876867044 on reference line 438 in /build/reproducible-path/mopac-23.0.3/tests and -1.872969271 on output line 472 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.577096858 on reference line 438 in /build/reproducible-path/mopac-23.0.3/tests and -1.57869064 on output line 472 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.113348029 on reference line 438 in /build/reproducible-path/mopac-23.0.3/tests and 0.115240943 on output line 472 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.403338838 on reference line 439 in /build/reproducible-path/mopac-23.0.3/tests and -1.402153096 on output line 473 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.275742279 on reference line 439 in /build/reproducible-path/mopac-23.0.3/tests and 1.278173698 on output line 473 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.603275776 on reference line 440 in /build/reproducible-path/mopac-23.0.3/tests and -1.591234509 on output line 474 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.714217106 on reference line 440 in /build/reproducible-path/mopac-23.0.3/tests and -0.720282951 on output line 474 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.896663428 on reference line 441 in /build/reproducible-path/mopac-23.0.3/tests and -0.892260715 on output line 475 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.545701046 on reference line 441 in /build/reproducible-path/mopac-23.0.3/tests and 0.543734438 on output line 475 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.523661208 on reference line 441 in /build/reproducible-path/mopac-23.0.3/tests and -0.522786801 on output line 475 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.399492042 on reference line 442 in /build/reproducible-path/mopac-23.0.3/tests and -1.402791439 on output line 476 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.434237348 on reference line 442 in /build/reproducible-path/mopac-23.0.3/tests and 1.431946961 on output line 476 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.68105693 on reference line 442 in /build/reproducible-path/mopac-23.0.3/tests and -1.676874811 on output line 476 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.005481052 on reference line 443 in /build/reproducible-path/mopac-23.0.3/tests and -1.019754381 on output line 477 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.874918282 on reference line 443 in /build/reproducible-path/mopac-23.0.3/tests and 2.875032985 on output line 477 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.499997236 on reference line 443 in /build/reproducible-path/mopac-23.0.3/tests and -1.491335315 on output line 477 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.273717388 on reference line 444 in /build/reproducible-path/mopac-23.0.3/tests and 0.256161226 on output line 478 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.114221371 on reference line 444 in /build/reproducible-path/mopac-23.0.3/tests and 3.122945857 on output line 478 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.135488352 on reference line 444 in /build/reproducible-path/mopac-23.0.3/tests and -1.121262542 on output line 478 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.733622831 on reference line 445 in /build/reproducible-path/mopac-23.0.3/tests and -1.754169539 on output line 479 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.816095283 on reference line 445 in /build/reproducible-path/mopac-23.0.3/tests and 3.811181238 on output line 479 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.678314861 on reference line 445 in /build/reproducible-path/mopac-23.0.3/tests and -1.670382498 on output line 479 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.535866704 on reference line 446 in /build/reproducible-path/mopac-23.0.3/tests and 0.541307914 on output line 480 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.35294005 on reference line 446 in /build/reproducible-path/mopac-23.0.3/tests and 0.359645661 on output line 480 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.544300056 on reference line 446 in /build/reproducible-path/mopac-23.0.3/tests and -0.54757691 on output line 480 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.335848505 on reference line 447 in /build/reproducible-path/mopac-23.0.3/tests and 1.343534549 on output line 481 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.108230641 on reference line 447 in /build/reproducible-path/mopac-23.0.3/tests and 0.108018674 on output line 481 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.617859472 on reference line 447 in /build/reproducible-path/mopac-23.0.3/tests and 0.611584944 on output line 481 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.574867837 on reference line 448 in /build/reproducible-path/mopac-23.0.3/tests and 1.579748854 on output line 482 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.371129093 on reference line 448 in /build/reproducible-path/mopac-23.0.3/tests and -1.372771499 on output line 482 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.818478582 on reference line 448 in /build/reproducible-path/mopac-23.0.3/tests and 0.804759278 on output line 482 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.683360684 on reference line 449 in /build/reproducible-path/mopac-23.0.3/tests and 2.691786298 on output line 483 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.76935628 on reference line 449 in /build/reproducible-path/mopac-23.0.3/tests and 0.767413732 on output line 483 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.426129397 on reference line 449 in /build/reproducible-path/mopac-23.0.3/tests and 0.419873779 on output line 483 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.730603491 on reference line 450 in /build/reproducible-path/mopac-23.0.3/tests and 0.741819666 on output line 484 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.661906999 on reference line 450 in /build/reproducible-path/mopac-23.0.3/tests and 0.657153468 on output line 484 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.877464999 on reference line 450 in /build/reproducible-path/mopac-23.0.3/tests and 1.874896519 on output line 484 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.838131354 on reference line 451 in /build/reproducible-path/mopac-23.0.3/tests and -2.503283943 on output line 485 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.682311282 on reference line 451 in /build/reproducible-path/mopac-23.0.3/tests and -2.874263449 on output line 485 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.48424696 on reference line 451 in /build/reproducible-path/mopac-23.0.3/tests and -1.501973174 on output line 485 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.991394346 on reference line 452 in /build/reproducible-path/mopac-23.0.3/tests and -2.237194309 on output line 486 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -3.681926971 on reference line 452 in /build/reproducible-path/mopac-23.0.3/tests and -3.69457777 on output line 486 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.280442585 on reference line 452 in /build/reproducible-path/mopac-23.0.3/tests and 0.060751296 on output line 486 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -3.540980929 on reference line 453 in /build/reproducible-path/mopac-23.0.3/tests and -3.678849367 on output line 487 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.928143419 on reference line 453 in /build/reproducible-path/mopac-23.0.3/tests and -2.690666519 on output line 487 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.135978891 on reference line 453 in /build/reproducible-path/mopac-23.0.3/tests and -0.182035218 on output line 487 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.326110741 on reference line 454 in /build/reproducible-path/mopac-23.0.3/tests and -1.320923843 on output line 488 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.884472829 on reference line 454 in /build/reproducible-path/mopac-23.0.3/tests and 0.878227277 on output line 488 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.445058023 on reference line 454 in /build/reproducible-path/mopac-23.0.3/tests and 0.44781147 on output line 488 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.005361818 on reference line 455 in /build/reproducible-path/mopac-23.0.3/tests and -1.006574575 on output line 489 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.055450177 on reference line 455 in /build/reproducible-path/mopac-23.0.3/tests and 1.059475464 on output line 489 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.647351904 on reference line 455 in /build/reproducible-path/mopac-23.0.3/tests and -2.644775165 on output line 489 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2.50472859 on reference line 456 in /build/reproducible-path/mopac-23.0.3/tests and -2.507390358 on output line 490 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.35261396 on reference line 456 in /build/reproducible-path/mopac-23.0.3/tests and 1.341976199 on output line 490 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.767148015 on reference line 456 in /build/reproducible-path/mopac-23.0.3/tests and -1.762629741 on output line 490 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.985173262 on reference line 457 in /build/reproducible-path/mopac-23.0.3/tests and 0.990795392 on output line 491 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.077587708 on reference line 457 in /build/reproducible-path/mopac-23.0.3/tests and 0.094337359 on output line 491 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.480159718 on reference line 457 in /build/reproducible-path/mopac-23.0.3/tests and -1.486236203 on output line 491 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.79430531 on reference line 458 in /build/reproducible-path/mopac-23.0.3/tests and 0.783148004 on output line 492 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.269386496 on reference line 458 in /build/reproducible-path/mopac-23.0.3/tests and 2.28164716 on output line 492 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.936979899 on reference line 458 in /build/reproducible-path/mopac-23.0.3/tests and -0.924516083 on output line 492 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.256532345 on reference line 459 in /build/reproducible-path/mopac-23.0.3/tests and 2.263084049 on output line 493 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.567342575 on reference line 459 in /build/reproducible-path/mopac-23.0.3/tests and -1.574485048 on output line 493 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.654517874 on reference line 459 in /build/reproducible-path/mopac-23.0.3/tests and 1.638063659 on output line 493 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.612032697 on reference line 460 in /build/reproducible-path/mopac-23.0.3/tests and 0.616268 on output line 494 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.877393446 on reference line 460 in /build/reproducible-path/mopac-23.0.3/tests and -1.877917377 on output line 494 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.026290549 on reference line 460 in /build/reproducible-path/mopac-23.0.3/tests and 1.012218605 on output line 494 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.981313156 on reference line 461 in /build/reproducible-path/mopac-23.0.3/tests and 1.982615646 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.819230069 on reference line 461 in /build/reproducible-path/mopac-23.0.3/tests and -1.81751169 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.100649828 on reference line 461 in /build/reproducible-path/mopac-23.0.3/tests and -0.117617173 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.348163288 on reference line 462 in /build/reproducible-path/mopac-23.0.3/tests and 3.35745006 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.585052253 on reference line 462 in /build/reproducible-path/mopac-23.0.3/tests and 0.579560352 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.280764055 on reference line 462 in /build/reproducible-path/mopac-23.0.3/tests and 1.273084147 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.169630004 on reference line 463 in /build/reproducible-path/mopac-23.0.3/tests and 3.176279737 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.392698797 on reference line 463 in /build/reproducible-path/mopac-23.0.3/tests and 0.39253518 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.488570355 on reference line 463 in /build/reproducible-path/mopac-23.0.3/tests and -0.496517329 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.55662468 on reference line 464 in /build/reproducible-path/mopac-23.0.3/tests and 2.566651926 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.859926715 on reference line 464 in /build/reproducible-path/mopac-23.0.3/tests and 1.858474937 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.303728634 on reference line 464 in /build/reproducible-path/mopac-23.0.3/tests and 0.300597677 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.490544291 on reference line 465 in /build/reproducible-path/mopac-23.0.3/tests and 0.501931705 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.732194119 on reference line 465 in /build/reproducible-path/mopac-23.0.3/tests and 1.727999612 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.754421617 on reference line 465 in /build/reproducible-path/mopac-23.0.3/tests and 1.75650557 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.216955506 on reference line 466 in /build/reproducible-path/mopac-23.0.3/tests and -0.205470067 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.130311996 on reference line 466 in /build/reproducible-path/mopac-23.0.3/tests and 0.125274965 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.118280491 on reference line 466 in /build/reproducible-path/mopac-23.0.3/tests and 2.116119787 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.40601706 on reference line 467 in /build/reproducible-path/mopac-23.0.3/tests and 1.419317072 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.54294822 on reference line 467 in /build/reproducible-path/mopac-23.0.3/tests and 0.534498209 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.735481703 on reference line 467 in /build/reproducible-path/mopac-23.0.3/tests and 2.730725261 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -37.75697 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -37.758 on output line 512 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -30.86924 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -30.87068 on output line 512 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -30.67089 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -30.67031 on output line 512 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -29.6694 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -29.66874 on output line 512 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -29.29795 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -29.29645 on output line 512 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -27.58679 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -27.58723 on output line 512 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -26.05072 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -26.05043 on output line 512 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -25.77464 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -25.77677 on output line 512 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -25.61711 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -25.61601 on output line 513 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -24.55775 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -24.55708 on output line 513 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -22.91416 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -22.91281 on output line 513 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -20.80122 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -20.79686 on output line 513 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -19.85203 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -19.85299 on output line 513 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -19.56616 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -19.56978 on output line 513 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -17.92319 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -17.92028 on output line 513 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -17.56184 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -17.56352 on output line 513 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -17.4333 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -17.43258 on output line 514 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -17.11986 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -17.12336 on output line 514 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -16.24491 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -16.2435 on output line 514 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -15.92288 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -15.90754 on output line 514 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -15.667 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -15.67381 on output line 514 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -15.07691 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -15.07813 on output line 514 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -14.98423 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -14.98366 on output line 514 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -14.78592 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -14.78618 on output line 514 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -14.49058 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -14.49166 on output line 515 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -14.12013 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -14.12673 on output line 515 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -13.85112 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.84937 on output line 515 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -13.79769 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.80013 on output line 515 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -13.75418 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.75396 on output line 515 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -13.63189 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.63088 on output line 515 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -13.57891 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.58487 on output line 515 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -13.10785 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.10466 on output line 515 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -12.97628 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -12.96861 on output line 516 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -12.82584 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -12.82535 on output line 516 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -12.33938 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -12.34508 on output line 516 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -11.8686 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -11.85868 on output line 516 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -11.23451 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -11.23296 on output line 516 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -11.01702 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -11.021 on output line 516 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -10.81164 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -10.81302 on output line 516 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -10.18538 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -10.18413 on output line 516 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -8.20804 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and -8.20869 on output line 517 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.87642 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 0.87614 on output line 517 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.3593 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 1.35755 on output line 517 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.60339 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 1.60478 on output line 517 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.89346 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 1.8911 on output line 517 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.88294 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 2.8823 on output line 517 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.05225 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 3.05282 on output line 517 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.73982 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 3.73834 on output line 518 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.00024 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.00053 on output line 518 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.13259 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.13337 on output line 518 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.46951 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.46874 on output line 518 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.48109 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.48021 on output line 518 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.58897 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.5878 on output line 518 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.65321 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.65381 on output line 518 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.78596 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 4.78687 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.84147 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 4.84221 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.01234 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.01182 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.12206 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.11994 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.13122 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.13989 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.19133 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.19217 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.28406 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.28227 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.52496 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.52388 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.54899 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.54993 on output line 520 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.71059 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.7128 on output line 520 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.81068 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.81025 on output line 520 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.8292 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.82868 on output line 520 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.90607 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.90545 on output line 520 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 6.29771 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 6.29792 on output line 520 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 6.39742 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 6.39594 on output line 520 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 6.58301 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 6.58349 on output line 520 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.516152 on reference line 493 in /build/reproducible-path/mopac-23.0.3/tests and -0.516699 on output line 527 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.5162 on reference line 493 in /build/reproducible-path/mopac-23.0.3/tests and 4.5167 on output line 527 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.45453 on reference line 493 in /build/reproducible-path/mopac-23.0.3/tests and 3.45503 on output line 527 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.664588 on reference line 494 in /build/reproducible-path/mopac-23.0.3/tests and 0.664036 on output line 528 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.3354 on reference line 494 in /build/reproducible-path/mopac-23.0.3/tests and 3.336 on output line 528 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.23109 on reference line 494 in /build/reproducible-path/mopac-23.0.3/tests and 2.23158 on output line 528 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.615107 on reference line 495 in /build/reproducible-path/mopac-23.0.3/tests and -0.614415 on output line 529 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 6.6151 on reference line 495 in /build/reproducible-path/mopac-23.0.3/tests and 6.6144 on output line 529 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.73831 on reference line 495 in /build/reproducible-path/mopac-23.0.3/tests and 4.7376 on output line 529 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.47906 on reference line 496 in /build/reproducible-path/mopac-23.0.3/tests and -0.479803 on output line 530 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 6.4791 on reference line 496 in /build/reproducible-path/mopac-23.0.3/tests and 6.4798 on output line 530 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.61147 on reference line 496 in /build/reproducible-path/mopac-23.0.3/tests and 4.61222 on output line 530 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.24763 on reference line 497 in /build/reproducible-path/mopac-23.0.3/tests and 0.247383 on output line 531 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.7524 on reference line 497 in /build/reproducible-path/mopac-23.0.3/tests and 3.7526 on output line 531 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.67417 on reference line 497 in /build/reproducible-path/mopac-23.0.3/tests and 2.67434 on output line 531 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.583573 on reference line 500 in /build/reproducible-path/mopac-23.0.3/tests and -0.583406 on output line 534 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 6.5836 on reference line 500 in /build/reproducible-path/mopac-23.0.3/tests and 6.5834 on output line 534 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.74303 on reference line 500 in /build/reproducible-path/mopac-23.0.3/tests and 4.7429 on output line 534 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.755243 on reference line 502 in /build/reproducible-path/mopac-23.0.3/tests and -0.754641 on output line 536 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.7552 on reference line 502 in /build/reproducible-path/mopac-23.0.3/tests and 4.7546 on output line 536 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.04316 on reference line 502 in /build/reproducible-path/mopac-23.0.3/tests and 1.04344 on output line 536 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.71208 on reference line 502 in /build/reproducible-path/mopac-23.0.3/tests and 3.7112 on output line 536 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.221733 on reference line 503 in /build/reproducible-path/mopac-23.0.3/tests and 0.221505 on output line 537 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.7783 on reference line 503 in /build/reproducible-path/mopac-23.0.3/tests and 4.7785 on output line 537 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.30753 on reference line 503 in /build/reproducible-path/mopac-23.0.3/tests and 3.30773 on output line 537 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.342573 on reference line 505 in /build/reproducible-path/mopac-23.0.3/tests and -0.342336 on output line 539 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.3426 on reference line 505 in /build/reproducible-path/mopac-23.0.3/tests and 4.3423 on output line 539 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 3.26087 on reference line 505 in /build/reproducible-path/mopac-23.0.3/tests and 3.26071 on output line 539 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.183542 on reference line 507 in /build/reproducible-path/mopac-23.0.3/tests and 0.182556 on output line 541 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.8165 on reference line 507 in /build/reproducible-path/mopac-23.0.3/tests and 0.8174 on output line 541 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.81646 on reference line 507 in /build/reproducible-path/mopac-23.0.3/tests and 0.81744 on output line 541 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.17701 on reference line 508 in /build/reproducible-path/mopac-23.0.3/tests and 0.177623 on output line 542 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.823 on reference line 508 in /build/reproducible-path/mopac-23.0.3/tests and 0.8224 on output line 542 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.82299 on reference line 508 in /build/reproducible-path/mopac-23.0.3/tests and 0.82238 on output line 542 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.184264 on reference line 509 in /build/reproducible-path/mopac-23.0.3/tests and 0.185297 on output line 543 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.8157 on reference line 509 in /build/reproducible-path/mopac-23.0.3/tests and 0.8147 on output line 543 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.81574 on reference line 509 in /build/reproducible-path/mopac-23.0.3/tests and 0.8147 on output line 543 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.126364 on reference line 510 in /build/reproducible-path/mopac-23.0.3/tests and 0.126466 on output line 544 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.87364 on reference line 510 in /build/reproducible-path/mopac-23.0.3/tests and 0.87353 on output line 544 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.195662 on reference line 516 in /build/reproducible-path/mopac-23.0.3/tests and 0.195545 on output line 550 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.8043 on reference line 516 in /build/reproducible-path/mopac-23.0.3/tests and 0.8045 on output line 550 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.80434 on reference line 516 in /build/reproducible-path/mopac-23.0.3/tests and 0.80446 on output line 550 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.166105 on reference line 517 in /build/reproducible-path/mopac-23.0.3/tests and 0.166318 on output line 551 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.8339 on reference line 517 in /build/reproducible-path/mopac-23.0.3/tests and 0.8337 on output line 551 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.8339 on reference line 517 in /build/reproducible-path/mopac-23.0.3/tests and 0.83368 on output line 551 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.822 on reference line 520 in /build/reproducible-path/mopac-23.0.3/tests and 0.8221 on output line 554 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 4.771 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 4.791 on output line 559 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -5.424 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and -5.415 on output line 559 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.478 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 2.449 on output line 559 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 7.637 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 7.634 on output line 559 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.334 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 0.312 on output line 560 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -0.706 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and -0.694 on output line 560 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.199 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 0.192 on output line 560 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.807 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 0.785 on output line 560 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 5.106 on reference line 527 in /build/reproducible-path/mopac-23.0.3/tests and 5.104 on output line 561 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -6.131 on reference line 527 in /build/reproducible-path/mopac-23.0.3/tests and -6.11 on output line 561 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 2.677 on reference line 527 in /build/reproducible-path/mopac-23.0.3/tests and 2.64 on output line 561 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 8.416 on reference line 527 in /build/reproducible-path/mopac-23.0.3/tests and 8.387 on output line 561 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.16563 on reference line 533 in /build/reproducible-path/mopac-23.0.3/tests and 1.16495 on output line 567 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.09826 on reference line 533 in /build/reproducible-path/mopac-23.0.3/tests and 1.10102 on output line 567 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.19064 on reference line 533 in /build/reproducible-path/mopac-23.0.3/tests and 1.18906 on output line 567 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.68583 on reference line 534 in /build/reproducible-path/mopac-23.0.3/tests and 0.68644 on output line 568 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.7836 on reference line 534 in /build/reproducible-path/mopac-23.0.3/tests and 0.78324 on output line 568 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.76166 on reference line 534 in /build/reproducible-path/mopac-23.0.3/tests and 0.7619 on output line 568 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.61161 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests and 1.61212 on output line 569 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.80564 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests and 1.80458 on output line 569 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.32106 on reference line 535 in /build/reproducible-path/mopac-23.0.3/tests and 1.32091 on output line 569 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.70983 on reference line 536 in /build/reproducible-path/mopac-23.0.3/tests and 1.71154 on output line 570 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.41841 on reference line 536 in /build/reproducible-path/mopac-23.0.3/tests and 1.4186 on output line 570 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.48323 on reference line 536 in /build/reproducible-path/mopac-23.0.3/tests and 1.48208 on output line 570 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.9148 on reference line 537 in /build/reproducible-path/mopac-23.0.3/tests and 0.91581 on output line 571 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.75545 on reference line 537 in /build/reproducible-path/mopac-23.0.3/tests and 0.75418 on output line 571 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.00391 on reference line 537 in /build/reproducible-path/mopac-23.0.3/tests and 1.00436 on output line 571 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.18437 on reference line 538 in /build/reproducible-path/mopac-23.0.3/tests and 1.18453 on output line 572 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.03671 on reference line 538 in /build/reproducible-path/mopac-23.0.3/tests and 1.03632 on output line 572 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.13301 on reference line 538 in /build/reproducible-path/mopac-23.0.3/tests and 1.13321 on output line 572 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.66911 on reference line 539 in /build/reproducible-path/mopac-23.0.3/tests and 0.66932 on output line 573 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.38411 on reference line 540 in /build/reproducible-path/mopac-23.0.3/tests and 1.38444 on output line 574 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.54063 on reference line 540 in /build/reproducible-path/mopac-23.0.3/tests and 1.54098 on output line 574 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.81829 on reference line 540 in /build/reproducible-path/mopac-23.0.3/tests and 1.81749 on output line 574 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.58 on reference line 541 in /build/reproducible-path/mopac-23.0.3/tests and 1.57541 on output line 575 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.50414 on reference line 541 in /build/reproducible-path/mopac-23.0.3/tests and 1.50813 on output line 575 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.51517 on reference line 541 in /build/reproducible-path/mopac-23.0.3/tests and 1.51577 on output line 575 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.04316 on reference line 542 in /build/reproducible-path/mopac-23.0.3/tests and 1.04344 on output line 576 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.02757 on reference line 542 in /build/reproducible-path/mopac-23.0.3/tests and 1.02505 on output line 576 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.74638 on reference line 542 in /build/reproducible-path/mopac-23.0.3/tests and 1.74714 on output line 576 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.93813 on reference line 542 in /build/reproducible-path/mopac-23.0.3/tests and 0.93901 on output line 576 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.07894 on reference line 543 in /build/reproducible-path/mopac-23.0.3/tests and 1.07908 on output line 577 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.9083 on reference line 544 in /build/reproducible-path/mopac-23.0.3/tests and 0.90754 on output line 578 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.17477 on reference line 544 in /build/reproducible-path/mopac-23.0.3/tests and 1.17537 on output line 578 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.93911 on reference line 545 in /build/reproducible-path/mopac-23.0.3/tests and 0.93863 on output line 579 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.14334 on reference line 545 in /build/reproducible-path/mopac-23.0.3/tests and 1.1436 on output line 579 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.16591 on reference line 546 in /build/reproducible-path/mopac-23.0.3/tests and 1.16641 on output line 580 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1.16678 on reference line 546 in /build/reproducible-path/mopac-23.0.3/tests and 1.1676 on output line 580 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.94759 on reference line 546 in /build/reproducible-path/mopac-23.0.3/tests and 0.94631 on output line 580 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.81646 on reference line 547 in /build/reproducible-path/mopac-23.0.3/tests and 0.81744 on output line 581 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.82299 on reference line 548 in /build/reproducible-path/mopac-23.0.3/tests and 0.82238 on output line 582 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.81574 on reference line 549 in /build/reproducible-path/mopac-23.0.3/tests and 0.8147 on output line 583 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.87364 on reference line 550 in /build/reproducible-path/mopac-23.0.3/tests and 0.87353 on output line 584 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.80434 on reference line 556 in /build/reproducible-path/mopac-23.0.3/tests and 0.80446 on output line 590 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 0.8339 on reference line 557 in /build/reproducible-path/mopac-23.0.3/tests and 0.83368 on output line 591 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -1.325 on reference line 567 in /build/reproducible-path/mopac-23.0.3/tests and -1.331 on output line 601 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -5.579 on reference line 567 in /build/reproducible-path/mopac-23.0.3/tests and -5.578 on output line 601 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -6.903 on reference line 567 in /build/reproducible-path/mopac-23.0.3/tests and -6.909 on output line 601 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -4054.5015 on reference line 576 in /build/reproducible-path/mopac-23.0.3/tests and -4054.5213 on output line 610 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 1748.4397 on reference line 577 in /build/reproducible-path/mopac-23.0.3/tests and 1748.4494 on output line 611 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2306.0618 on reference line 579 in /build/reproducible-path/mopac-23.0.3/tests and -2306.0719 on output line 613 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -391.1003 on reference line 583 in /build/reproducible-path/mopac-23.0.3/tests and -391.0962 on output line 617 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -554.0685 on reference line 586 in /build/reproducible-path/mopac-23.0.3/tests and -554.0644 on output line 620 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 13473.4859 on reference line 588 in /build/reproducible-path/mopac-23.0.3/tests and 13471.3793 on output line 622 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -27163.3213 on reference line 589 in /build/reproducible-path/mopac-23.0.3/tests and -27159.0965 on output line 623 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 13847.8465 on reference line 590 in /build/reproducible-path/mopac-23.0.3/tests and 13845.7339 on output line 624 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between 158.0111 on reference line 592 in /build/reproducible-path/mopac-23.0.3/tests and 158.0167 on output line 626 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -396.0574 on reference line 594 in /build/reproducible-path/mopac-23.0.3/tests and -396.0477 on output line 628 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -27: WARNING: numerical mismatch between -2702.1191 on reference line 596 in /build/reproducible-path/mopac-23.0.3/tests and -2702.1196 on output line 630 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -118/124 Test #27: erratic-1 ........................ Passed 22.27 sec -60: -60: -60: MOPAC Job: "poly_c8_mr.mop" ended normally on Jan 20, 2025, at 15:04. -60: -119/124 Test #60: poly_c8_mr ....................... Passed 15.11 sec +111/124 Test #121: key-TRIPLET ...................... Passed 0.29 sec +112/124 Test #119: key-SYMMETRY ..................... Passed 0.39 sec +113/124 Test #123: key-WRTCI ........................ Passed 0.30 sec +32: +32: +32: MOPAC Job: "ag20_cis_active.mop" ended normally on Feb 23, 2026, at 23:29. +32: +32: WARNING: numerical mismatch between 2.918 on reference line 69 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 69 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +32: WARNING: numerical mismatch between 2.918 on reference line 70 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 70 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +32: WARNING: numerical mismatch between 2.918 on reference line 71 in /build/reproducible-path/mopac-23.0.3/tests/INDO-dev and 2.9179 on output line 71 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114/124 Test #32: ag20_cis_active .................. Passed 5.86 sec 82: 82: -82: MOPAC Job: "CISDT.mop" ended normally on Jan 20, 2025, at 15:04. +82: MOPAC Job: "CISDT.mop" ended normally on Feb 23, 2026, at 23:29. 82: 82: WARNING: numerical heat mismatch between 6.52314 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 6.52269 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 82: WARNING: numerical mismatch between 27.29281 on reference line 78 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 27.29093 on output line 78 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 82: WARNING: numerical heat mismatch between 6.58382 on reference line 1857 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 6.58337 on output line 1857 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 82: WARNING: numerical mismatch between 27.54671 on reference line 1857 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 27.54483 on output line 1857 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -120/124 Test #82: key-CISDT ........................ Passed 9.34 sec +115/124 Test #82: key-CISDT ........................ Passed 4.88 sec +30: Passed API test 10 +116/124 Test #30: mopac-api-test ................... Passed 7.58 sec +60: +60: +60: MOPAC Job: "poly_c8_mr.mop" ended normally on Feb 23, 2026, at 23:29. +60: +21: +21: +21: MOPAC Job: "Compare_PDB_Bacteriorhodopsin_1AP9_and_1AT9.mop" ended normally on Feb 23, 2026, at 23:29. +21: +117/124 Test #60: poly_c8_mr ....................... Passed 7.01 sec +118/124 Test #21: pdb_compare6 ..................... Passed 6.42 sec +28: +28: +28: MOPAC Job: "erratic2.mop" ended normally on Feb 23, 2026, at 23:29. +28: +28: WARNING: numerical mismatch between 535.23 on reference line 257 in /build/reproducible-path/mopac-23.0.3/tests and 535.22 on output line 257 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +119/124 Test #28: erratic-2 ........................ Passed 8.65 sec +27: +27: +27: MOPAC Job: "erratic1.mop" ended normally on Feb 23, 2026, at 23:29. +27: +27: WARNING: numerical heat mismatch between -167.66206 on reference line 360 in /build/reproducible-path/mopac-23.0.3/tests and -167.66712 on output line 377 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -701.49806 on reference line 360 in /build/reproducible-path/mopac-23.0.3/tests and -701.51921 on output line 377 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -62312.34782 on reference line 362 in /build/reproducible-path/mopac-23.0.3/tests and -62312.35382 on output line 379 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -160.75863 on reference line 364 in /build/reproducible-path/mopac-23.0.3/tests and -160.76463 on output line 381 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -5.57884 on reference line 365 in /build/reproducible-path/mopac-23.0.3/tests and -5.57871 on output line 382 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.32459 on reference line 366 in /build/reproducible-path/mopac-23.0.3/tests and -1.32378 on output line 383 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -167.66206 on reference line 367 in /build/reproducible-path/mopac-23.0.3/tests and -167.66712 on output line 384 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2702.11915 on reference line 372 in /build/reproducible-path/mopac-23.0.3/tests and -2702.11941 on output line 389 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -16549.96563 on reference line 373 in /build/reproducible-path/mopac-23.0.3/tests and -16549.66602 on output line 390 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 13847.84648 on reference line 374 in /build/reproducible-path/mopac-23.0.3/tests and 13847.54662 on output line 391 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 230.06 on reference line 375 in /build/reproducible-path/mopac-23.0.3/tests and 230.14 on output line 392 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 254.54 on reference line 376 in /build/reproducible-path/mopac-23.0.3/tests and 254.43 on output line 393 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.876 on reference line 380 in /build/reproducible-path/mopac-23.0.3/tests and 0.877 on output line 397 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.59953271 on reference line 403 in /build/reproducible-path/mopac-23.0.3/tests and -2.59997281 on output line 420 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.77575526 on reference line 403 in /build/reproducible-path/mopac-23.0.3/tests and -2.77541489 on output line 420 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.41403348 on reference line 403 in /build/reproducible-path/mopac-23.0.3/tests and -0.41353377 on output line 420 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.87686704 on reference line 404 in /build/reproducible-path/mopac-23.0.3/tests and -1.87587639 on output line 421 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.57709686 on reference line 404 in /build/reproducible-path/mopac-23.0.3/tests and -1.5775638 on output line 421 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.11334803 on reference line 404 in /build/reproducible-path/mopac-23.0.3/tests and 0.11363794 on output line 421 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.5710808 on reference line 405 in /build/reproducible-path/mopac-23.0.3/tests and -1.57094654 on output line 422 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.27574228 on reference line 405 in /build/reproducible-path/mopac-23.0.3/tests and 1.27620269 on output line 422 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.60327578 on reference line 406 in /build/reproducible-path/mopac-23.0.3/tests and -1.60121554 on output line 423 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.71421711 on reference line 406 in /build/reproducible-path/mopac-23.0.3/tests and -0.7151928 on output line 423 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.85842567 on reference line 406 in /build/reproducible-path/mopac-23.0.3/tests and -0.85828708 on output line 423 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.89666343 on reference line 407 in /build/reproducible-path/mopac-23.0.3/tests and -0.89619559 on output line 424 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.54570105 on reference line 407 in /build/reproducible-path/mopac-23.0.3/tests and 0.54557395 on output line 424 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.52366121 on reference line 407 in /build/reproducible-path/mopac-23.0.3/tests and -0.52327512 on output line 424 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.39949204 on reference line 408 in /build/reproducible-path/mopac-23.0.3/tests and -1.40067583 on output line 425 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.68105693 on reference line 408 in /build/reproducible-path/mopac-23.0.3/tests and -1.67985599 on output line 425 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.00548105 on reference line 409 in /build/reproducible-path/mopac-23.0.3/tests and -1.00752011 on output line 426 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.87491828 on reference line 409 in /build/reproducible-path/mopac-23.0.3/tests and 2.87504529 on output line 426 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.49999724 on reference line 409 in /build/reproducible-path/mopac-23.0.3/tests and -1.49828403 on output line 426 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.27371739 on reference line 410 in /build/reproducible-path/mopac-23.0.3/tests and 0.27242636 on output line 427 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.11422137 on reference line 410 in /build/reproducible-path/mopac-23.0.3/tests and 3.11508998 on output line 427 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.13548835 on reference line 410 in /build/reproducible-path/mopac-23.0.3/tests and -1.13700208 on output line 427 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.73362283 on reference line 411 in /build/reproducible-path/mopac-23.0.3/tests and -1.73700284 on output line 428 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.81609528 on reference line 411 in /build/reproducible-path/mopac-23.0.3/tests and 3.8157186 on output line 428 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.67831486 on reference line 411 in /build/reproducible-path/mopac-23.0.3/tests and -1.67370239 on output line 428 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.5358667 on reference line 412 in /build/reproducible-path/mopac-23.0.3/tests and 0.53651602 on output line 429 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.35294005 on reference line 412 in /build/reproducible-path/mopac-23.0.3/tests and 0.35436066 on output line 429 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.54430006 on reference line 412 in /build/reproducible-path/mopac-23.0.3/tests and -0.54485529 on output line 429 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.33584851 on reference line 413 in /build/reproducible-path/mopac-23.0.3/tests and 1.33692314 on output line 430 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.61785947 on reference line 413 in /build/reproducible-path/mopac-23.0.3/tests and 0.61673069 on output line 430 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.57486784 on reference line 414 in /build/reproducible-path/mopac-23.0.3/tests and 1.57629196 on output line 431 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.37112909 on reference line 414 in /build/reproducible-path/mopac-23.0.3/tests and -1.3713028 on output line 431 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.81847858 on reference line 414 in /build/reproducible-path/mopac-23.0.3/tests and 0.8150554 on output line 431 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.68336068 on reference line 415 in /build/reproducible-path/mopac-23.0.3/tests and 2.68413643 on output line 432 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.76935628 on reference line 415 in /build/reproducible-path/mopac-23.0.3/tests and 0.77016029 on output line 432 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.4261294 on reference line 415 in /build/reproducible-path/mopac-23.0.3/tests and 0.42558195 on output line 432 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.73060349 on reference line 416 in /build/reproducible-path/mopac-23.0.3/tests and 0.73186252 on output line 433 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.661907 on reference line 416 in /build/reproducible-path/mopac-23.0.3/tests and 0.65992482 on output line 433 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.877465 on reference line 416 in /build/reproducible-path/mopac-23.0.3/tests and 1.87733127 on output line 433 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.83813135 on reference line 417 in /build/reproducible-path/mopac-23.0.3/tests and -2.76504408 on output line 434 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.68231128 on reference line 417 in /build/reproducible-path/mopac-23.0.3/tests and -2.71923597 on output line 434 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.48424696 on reference line 417 in /build/reproducible-path/mopac-23.0.3/tests and -1.50005658 on output line 434 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.99139435 on reference line 418 in /build/reproducible-path/mopac-23.0.3/tests and -2.03343282 on output line 435 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -3.68192697 on reference line 418 in /build/reproducible-path/mopac-23.0.3/tests and -3.69345251 on output line 435 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.28044258 on reference line 418 in /build/reproducible-path/mopac-23.0.3/tests and -0.20157248 on output line 435 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -3.54098093 on reference line 419 in /build/reproducible-path/mopac-23.0.3/tests and -3.58090514 on output line 436 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.92814342 on reference line 419 in /build/reproducible-path/mopac-23.0.3/tests and -2.8750534 on output line 436 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.13597889 on reference line 419 in /build/reproducible-path/mopac-23.0.3/tests and 0.07655905 on output line 436 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.32611074 on reference line 420 in /build/reproducible-path/mopac-23.0.3/tests and -1.32543167 on output line 437 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.88447283 on reference line 420 in /build/reproducible-path/mopac-23.0.3/tests and 0.88340365 on output line 437 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.44505802 on reference line 420 in /build/reproducible-path/mopac-23.0.3/tests and 0.44587083 on output line 437 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.00536182 on reference line 421 in /build/reproducible-path/mopac-23.0.3/tests and -1.0070379 on output line 438 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.05545018 on reference line 421 in /build/reproducible-path/mopac-23.0.3/tests and 1.05615218 on output line 438 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.6473519 on reference line 421 in /build/reproducible-path/mopac-23.0.3/tests and -2.64664444 on output line 438 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.50472859 on reference line 422 in /build/reproducible-path/mopac-23.0.3/tests and -2.50591295 on output line 439 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.35261396 on reference line 422 in /build/reproducible-path/mopac-23.0.3/tests and 1.35174976 on output line 439 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.76714801 on reference line 422 in /build/reproducible-path/mopac-23.0.3/tests and -1.76507316 on output line 439 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.98517326 on reference line 423 in /build/reproducible-path/mopac-23.0.3/tests and 0.98574512 on output line 440 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.07758771 on reference line 423 in /build/reproducible-path/mopac-23.0.3/tests and 0.08062721 on output line 440 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.48015972 on reference line 423 in /build/reproducible-path/mopac-23.0.3/tests and -1.48123869 on output line 440 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.79430531 on reference line 424 in /build/reproducible-path/mopac-23.0.3/tests and 0.79376439 on output line 441 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.2693865 on reference line 424 in /build/reproducible-path/mopac-23.0.3/tests and 2.27060992 on output line 441 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.9369799 on reference line 424 in /build/reproducible-path/mopac-23.0.3/tests and -0.93878662 on output line 441 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.25653234 on reference line 425 in /build/reproducible-path/mopac-23.0.3/tests and 2.2595851 on output line 442 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.56734258 on reference line 425 in /build/reproducible-path/mopac-23.0.3/tests and -1.56858617 on output line 442 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.65451787 on reference line 425 in /build/reproducible-path/mopac-23.0.3/tests and 1.64949242 on output line 442 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.6120327 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests and 0.61382967 on output line 443 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.87739345 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests and -1.87782443 on output line 443 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.02629055 on reference line 426 in /build/reproducible-path/mopac-23.0.3/tests and 1.02391467 on output line 443 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.98131316 on reference line 427 in /build/reproducible-path/mopac-23.0.3/tests and 1.98086605 on output line 444 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.81923007 on reference line 427 in /build/reproducible-path/mopac-23.0.3/tests and -1.81826207 on output line 444 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.10064983 on reference line 427 in /build/reproducible-path/mopac-23.0.3/tests and -0.10546858 on output line 444 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.34816329 on reference line 428 in /build/reproducible-path/mopac-23.0.3/tests and 3.34874331 on output line 445 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.58505225 on reference line 428 in /build/reproducible-path/mopac-23.0.3/tests and 0.5860162 on output line 445 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.28076405 on reference line 428 in /build/reproducible-path/mopac-23.0.3/tests and 1.28040498 on output line 445 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.16963 on reference line 429 in /build/reproducible-path/mopac-23.0.3/tests and 3.17094365 on output line 446 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.3926988 on reference line 429 in /build/reproducible-path/mopac-23.0.3/tests and 0.39399535 on output line 446 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.48857036 on reference line 429 in /build/reproducible-path/mopac-23.0.3/tests and -0.48902333 on output line 446 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.55662468 on reference line 430 in /build/reproducible-path/mopac-23.0.3/tests and 2.55679027 on output line 447 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.85992671 on reference line 430 in /build/reproducible-path/mopac-23.0.3/tests and 1.86069058 on output line 447 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.30372863 on reference line 430 in /build/reproducible-path/mopac-23.0.3/tests and 0.30343242 on output line 447 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.73219412 on reference line 431 in /build/reproducible-path/mopac-23.0.3/tests and 1.73009453 on output line 448 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.75442162 on reference line 431 in /build/reproducible-path/mopac-23.0.3/tests and 1.75569722 on output line 448 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.21695551 on reference line 432 in /build/reproducible-path/mopac-23.0.3/tests and -0.21506263 on output line 449 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.130312 on reference line 432 in /build/reproducible-path/mopac-23.0.3/tests and 0.12716863 on output line 449 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.11828049 on reference line 432 in /build/reproducible-path/mopac-23.0.3/tests and 2.11809579 on output line 449 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.40601706 on reference line 433 in /build/reproducible-path/mopac-23.0.3/tests and 1.40788185 on output line 450 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.54294822 on reference line 433 in /build/reproducible-path/mopac-23.0.3/tests and 0.54058405 on output line 450 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.7354817 on reference line 433 in /build/reproducible-path/mopac-23.0.3/tests and 2.73481108 on output line 450 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.599532711 on reference line 437 in /build/reproducible-path/mopac-23.0.3/tests and -2.599972806 on output line 454 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.775755262 on reference line 437 in /build/reproducible-path/mopac-23.0.3/tests and -2.775414894 on output line 454 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.414033476 on reference line 437 in /build/reproducible-path/mopac-23.0.3/tests and -0.413533771 on output line 454 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.876867044 on reference line 438 in /build/reproducible-path/mopac-23.0.3/tests and -1.875876388 on output line 455 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.577096858 on reference line 438 in /build/reproducible-path/mopac-23.0.3/tests and -1.577563796 on output line 455 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.113348029 on reference line 438 in /build/reproducible-path/mopac-23.0.3/tests and 0.113637942 on output line 455 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.571080805 on reference line 439 in /build/reproducible-path/mopac-23.0.3/tests and -1.570946544 on output line 456 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.275742279 on reference line 439 in /build/reproducible-path/mopac-23.0.3/tests and 1.276202694 on output line 456 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.603275776 on reference line 440 in /build/reproducible-path/mopac-23.0.3/tests and -1.60121554 on output line 457 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.714217106 on reference line 440 in /build/reproducible-path/mopac-23.0.3/tests and -0.7151928 on output line 457 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.858425666 on reference line 440 in /build/reproducible-path/mopac-23.0.3/tests and -0.858287075 on output line 457 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.896663428 on reference line 441 in /build/reproducible-path/mopac-23.0.3/tests and -0.896195592 on output line 458 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.545701046 on reference line 441 in /build/reproducible-path/mopac-23.0.3/tests and 0.545573951 on output line 458 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.523661208 on reference line 441 in /build/reproducible-path/mopac-23.0.3/tests and -0.523275118 on output line 458 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.399492042 on reference line 442 in /build/reproducible-path/mopac-23.0.3/tests and -1.400675831 on output line 459 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.68105693 on reference line 442 in /build/reproducible-path/mopac-23.0.3/tests and -1.679855987 on output line 459 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.005481052 on reference line 443 in /build/reproducible-path/mopac-23.0.3/tests and -1.007520112 on output line 460 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.874918282 on reference line 443 in /build/reproducible-path/mopac-23.0.3/tests and 2.875045289 on output line 460 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.499997236 on reference line 443 in /build/reproducible-path/mopac-23.0.3/tests and -1.498284027 on output line 460 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.273717388 on reference line 444 in /build/reproducible-path/mopac-23.0.3/tests and 0.272426364 on output line 461 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.114221371 on reference line 444 in /build/reproducible-path/mopac-23.0.3/tests and 3.115089984 on output line 461 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.135488352 on reference line 444 in /build/reproducible-path/mopac-23.0.3/tests and -1.137002079 on output line 461 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.733622831 on reference line 445 in /build/reproducible-path/mopac-23.0.3/tests and -1.737002839 on output line 462 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.816095283 on reference line 445 in /build/reproducible-path/mopac-23.0.3/tests and 3.815718603 on output line 462 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.678314861 on reference line 445 in /build/reproducible-path/mopac-23.0.3/tests and -1.673702385 on output line 462 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.535866704 on reference line 446 in /build/reproducible-path/mopac-23.0.3/tests and 0.536516023 on output line 463 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.35294005 on reference line 446 in /build/reproducible-path/mopac-23.0.3/tests and 0.35436066 on output line 463 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.544300056 on reference line 446 in /build/reproducible-path/mopac-23.0.3/tests and -0.544855289 on output line 463 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.335848505 on reference line 447 in /build/reproducible-path/mopac-23.0.3/tests and 1.336923143 on output line 464 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.617859472 on reference line 447 in /build/reproducible-path/mopac-23.0.3/tests and 0.616730691 on output line 464 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.574867837 on reference line 448 in /build/reproducible-path/mopac-23.0.3/tests and 1.576291962 on output line 465 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.371129093 on reference line 448 in /build/reproducible-path/mopac-23.0.3/tests and -1.371302795 on output line 465 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.818478582 on reference line 448 in /build/reproducible-path/mopac-23.0.3/tests and 0.815055401 on output line 465 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.683360684 on reference line 449 in /build/reproducible-path/mopac-23.0.3/tests and 2.684136433 on output line 466 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.76935628 on reference line 449 in /build/reproducible-path/mopac-23.0.3/tests and 0.77016029 on output line 466 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.426129397 on reference line 449 in /build/reproducible-path/mopac-23.0.3/tests and 0.425581951 on output line 466 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.730603491 on reference line 450 in /build/reproducible-path/mopac-23.0.3/tests and 0.731862518 on output line 467 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.661906999 on reference line 450 in /build/reproducible-path/mopac-23.0.3/tests and 0.659924818 on output line 467 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.877464999 on reference line 450 in /build/reproducible-path/mopac-23.0.3/tests and 1.877331271 on output line 467 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.838131354 on reference line 451 in /build/reproducible-path/mopac-23.0.3/tests and -2.765044078 on output line 468 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.682311282 on reference line 451 in /build/reproducible-path/mopac-23.0.3/tests and -2.719235966 on output line 468 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.48424696 on reference line 451 in /build/reproducible-path/mopac-23.0.3/tests and -1.500056582 on output line 468 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.991394346 on reference line 452 in /build/reproducible-path/mopac-23.0.3/tests and -2.033432818 on output line 469 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -3.681926971 on reference line 452 in /build/reproducible-path/mopac-23.0.3/tests and -3.693452509 on output line 469 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.280442585 on reference line 452 in /build/reproducible-path/mopac-23.0.3/tests and -0.201572483 on output line 469 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -3.540980929 on reference line 453 in /build/reproducible-path/mopac-23.0.3/tests and -3.580905144 on output line 470 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.928143419 on reference line 453 in /build/reproducible-path/mopac-23.0.3/tests and -2.875053402 on output line 470 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.135978891 on reference line 453 in /build/reproducible-path/mopac-23.0.3/tests and 0.076559047 on output line 470 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.326110741 on reference line 454 in /build/reproducible-path/mopac-23.0.3/tests and -1.325431668 on output line 471 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.884472829 on reference line 454 in /build/reproducible-path/mopac-23.0.3/tests and 0.88340365 on output line 471 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.445058023 on reference line 454 in /build/reproducible-path/mopac-23.0.3/tests and 0.445870829 on output line 471 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.005361818 on reference line 455 in /build/reproducible-path/mopac-23.0.3/tests and -1.007037897 on output line 472 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.055450177 on reference line 455 in /build/reproducible-path/mopac-23.0.3/tests and 1.056152178 on output line 472 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.647351904 on reference line 455 in /build/reproducible-path/mopac-23.0.3/tests and -2.646644436 on output line 472 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2.50472859 on reference line 456 in /build/reproducible-path/mopac-23.0.3/tests and -2.505912954 on output line 473 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.35261396 on reference line 456 in /build/reproducible-path/mopac-23.0.3/tests and 1.351749762 on output line 473 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.767148015 on reference line 456 in /build/reproducible-path/mopac-23.0.3/tests and -1.765073159 on output line 473 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.985173262 on reference line 457 in /build/reproducible-path/mopac-23.0.3/tests and 0.985745117 on output line 474 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.077587708 on reference line 457 in /build/reproducible-path/mopac-23.0.3/tests and 0.080627211 on output line 474 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.480159718 on reference line 457 in /build/reproducible-path/mopac-23.0.3/tests and -1.481238687 on output line 474 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.79430531 on reference line 458 in /build/reproducible-path/mopac-23.0.3/tests and 0.793764391 on output line 475 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.269386496 on reference line 458 in /build/reproducible-path/mopac-23.0.3/tests and 2.27060992 on output line 475 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.936979899 on reference line 458 in /build/reproducible-path/mopac-23.0.3/tests and -0.938786617 on output line 475 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.256532345 on reference line 459 in /build/reproducible-path/mopac-23.0.3/tests and 2.259585099 on output line 476 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.567342575 on reference line 459 in /build/reproducible-path/mopac-23.0.3/tests and -1.56858617 on output line 476 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.654517874 on reference line 459 in /build/reproducible-path/mopac-23.0.3/tests and 1.649492424 on output line 476 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.612032697 on reference line 460 in /build/reproducible-path/mopac-23.0.3/tests and 0.61382967 on output line 477 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.877393446 on reference line 460 in /build/reproducible-path/mopac-23.0.3/tests and -1.87782443 on output line 477 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.026290549 on reference line 460 in /build/reproducible-path/mopac-23.0.3/tests and 1.023914673 on output line 477 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.981313156 on reference line 461 in /build/reproducible-path/mopac-23.0.3/tests and 1.980866048 on output line 478 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.819230069 on reference line 461 in /build/reproducible-path/mopac-23.0.3/tests and -1.818262073 on output line 478 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.100649828 on reference line 461 in /build/reproducible-path/mopac-23.0.3/tests and -0.105468581 on output line 478 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.348163288 on reference line 462 in /build/reproducible-path/mopac-23.0.3/tests and 3.34874331 on output line 479 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.585052253 on reference line 462 in /build/reproducible-path/mopac-23.0.3/tests and 0.586016204 on output line 479 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.280764055 on reference line 462 in /build/reproducible-path/mopac-23.0.3/tests and 1.280404984 on output line 479 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.169630004 on reference line 463 in /build/reproducible-path/mopac-23.0.3/tests and 3.17094365 on output line 480 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.392698797 on reference line 463 in /build/reproducible-path/mopac-23.0.3/tests and 0.393995346 on output line 480 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.488570355 on reference line 463 in /build/reproducible-path/mopac-23.0.3/tests and -0.489023326 on output line 480 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.55662468 on reference line 464 in /build/reproducible-path/mopac-23.0.3/tests and 2.556790266 on output line 481 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.859926715 on reference line 464 in /build/reproducible-path/mopac-23.0.3/tests and 1.860690576 on output line 481 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.303728634 on reference line 464 in /build/reproducible-path/mopac-23.0.3/tests and 0.303432424 on output line 481 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.732194119 on reference line 465 in /build/reproducible-path/mopac-23.0.3/tests and 1.730094525 on output line 482 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.754421617 on reference line 465 in /build/reproducible-path/mopac-23.0.3/tests and 1.755697223 on output line 482 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.216955506 on reference line 466 in /build/reproducible-path/mopac-23.0.3/tests and -0.215062634 on output line 483 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.130311996 on reference line 466 in /build/reproducible-path/mopac-23.0.3/tests and 0.127168633 on output line 483 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.118280491 on reference line 466 in /build/reproducible-path/mopac-23.0.3/tests and 2.118095795 on output line 483 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.40601706 on reference line 467 in /build/reproducible-path/mopac-23.0.3/tests and 1.407881847 on output line 484 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.54294822 on reference line 467 in /build/reproducible-path/mopac-23.0.3/tests and 0.540584049 on output line 484 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.735481703 on reference line 467 in /build/reproducible-path/mopac-23.0.3/tests and 2.734811079 on output line 484 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -37.75697 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -37.75686 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -30.86924 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -30.86943 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -30.67089 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -30.67063 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -29.6694 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -29.66894 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -29.29795 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -29.29781 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -26.05072 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -26.05083 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -25.77464 on reference line 478 in /build/reproducible-path/mopac-23.0.3/tests and -25.77442 on output line 495 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -24.55775 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -24.55744 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -22.91416 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -22.91375 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -20.80122 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -20.80059 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -19.85203 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -19.85167 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -19.56616 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -19.56705 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -17.92319 on reference line 479 in /build/reproducible-path/mopac-23.0.3/tests and -17.9219 on output line 496 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -17.4333 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -17.43303 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -17.11986 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -17.12084 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -16.24491 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -16.24513 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -15.92288 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -15.91921 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -15.667 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -15.66905 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -15.07691 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -15.07597 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -14.98423 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -14.98412 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -14.78592 on reference line 480 in /build/reproducible-path/mopac-23.0.3/tests and -14.7861 on output line 497 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -14.49058 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -14.49002 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -14.12013 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -14.12162 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -13.85112 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.85025 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -13.79769 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.79671 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -13.75418 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.75387 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -13.63189 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.63075 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -13.57891 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.58149 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -13.10785 on reference line 481 in /build/reproducible-path/mopac-23.0.3/tests and -13.10823 on output line 498 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -12.97628 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -12.97566 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -12.82584 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -12.82457 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -12.33938 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -12.34066 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -11.8686 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -11.86639 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -11.23451 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -11.23391 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -11.01702 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -11.01775 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -10.81164 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -10.81178 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -10.18538 on reference line 482 in /build/reproducible-path/mopac-23.0.3/tests and -10.18488 on output line 499 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.87642 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 0.87671 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.3593 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 1.35905 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.89346 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 1.8937 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.80006 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 2.80045 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.88294 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 2.8834 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.05225 on reference line 483 in /build/reproducible-path/mopac-23.0.3/tests and 3.05269 on output line 500 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.73982 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 3.73996 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 4.00024 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.00057 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 4.13259 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.13294 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 4.46951 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.4699 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 4.48109 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.48142 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 4.58897 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.5888 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 4.65321 on reference line 484 in /build/reproducible-path/mopac-23.0.3/tests and 4.65334 on output line 501 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 4.84147 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 4.84212 on output line 502 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.01234 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.01198 on output line 502 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.12206 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.12139 on output line 502 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.13122 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.13282 on output line 502 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.19133 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.19113 on output line 502 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.28406 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.2842 on output line 502 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.52496 on reference line 485 in /build/reproducible-path/mopac-23.0.3/tests and 5.52512 on output line 502 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.54899 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.54913 on output line 503 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.71059 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.7109 on output line 503 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.81068 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.81121 on output line 503 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.8292 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.82903 on output line 503 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.90607 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 5.90646 on output line 503 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 6.29771 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 6.2981 on output line 503 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 6.58301 on reference line 486 in /build/reproducible-path/mopac-23.0.3/tests and 6.58331 on output line 503 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 7.24994 on reference line 487 in /build/reproducible-path/mopac-23.0.3/tests and 7.2495 on output line 504 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.3354 on reference line 494 in /build/reproducible-path/mopac-23.0.3/tests and 3.3355 on output line 511 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.755243 on reference line 502 in /build/reproducible-path/mopac-23.0.3/tests and -0.755137 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 4.7552 on reference line 502 in /build/reproducible-path/mopac-23.0.3/tests and 4.7551 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 3.71208 on reference line 502 in /build/reproducible-path/mopac-23.0.3/tests and 3.71193 on output line 519 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.183542 on reference line 507 in /build/reproducible-path/mopac-23.0.3/tests and 0.183335 on output line 524 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.8165 on reference line 507 in /build/reproducible-path/mopac-23.0.3/tests and 0.8167 on output line 524 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.81646 on reference line 507 in /build/reproducible-path/mopac-23.0.3/tests and 0.81667 on output line 524 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.184264 on reference line 509 in /build/reproducible-path/mopac-23.0.3/tests and 0.184536 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.8157 on reference line 509 in /build/reproducible-path/mopac-23.0.3/tests and 0.8155 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.81574 on reference line 509 in /build/reproducible-path/mopac-23.0.3/tests and 0.81546 on output line 526 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.478 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 2.472 on output line 542 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 7.637 on reference line 525 in /build/reproducible-path/mopac-23.0.3/tests and 7.635 on output line 542 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.334 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 0.329 on output line 543 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -0.706 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and -0.705 on output line 543 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.199 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 0.2 on output line 543 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.807 on reference line 526 in /build/reproducible-path/mopac-23.0.3/tests and 0.803 on output line 543 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 5.106 on reference line 527 in /build/reproducible-path/mopac-23.0.3/tests and 5.1 on output line 544 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -6.131 on reference line 527 in /build/reproducible-path/mopac-23.0.3/tests and -6.129 on output line 544 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 2.677 on reference line 527 in /build/reproducible-path/mopac-23.0.3/tests and 2.672 on output line 544 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 8.416 on reference line 527 in /build/reproducible-path/mopac-23.0.3/tests and 8.409 on output line 544 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.16563 on reference line 533 in /build/reproducible-path/mopac-23.0.3/tests and 1.16544 on output line 550 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.09826 on reference line 533 in /build/reproducible-path/mopac-23.0.3/tests and 1.09859 on output line 550 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.70983 on reference line 536 in /build/reproducible-path/mopac-23.0.3/tests and 1.71013 on output line 553 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.41841 on reference line 536 in /build/reproducible-path/mopac-23.0.3/tests and 1.41828 on output line 553 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.48323 on reference line 536 in /build/reproducible-path/mopac-23.0.3/tests and 1.48304 on output line 553 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.9148 on reference line 537 in /build/reproducible-path/mopac-23.0.3/tests and 0.915 on output line 554 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.75545 on reference line 537 in /build/reproducible-path/mopac-23.0.3/tests and 0.75522 on output line 554 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.00391 on reference line 537 in /build/reproducible-path/mopac-23.0.3/tests and 1.00402 on output line 554 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.73331 on reference line 539 in /build/reproducible-path/mopac-23.0.3/tests and 0.73343 on output line 556 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.38411 on reference line 540 in /build/reproducible-path/mopac-23.0.3/tests and 1.38339 on output line 557 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.54063 on reference line 540 in /build/reproducible-path/mopac-23.0.3/tests and 1.54074 on output line 557 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.81829 on reference line 540 in /build/reproducible-path/mopac-23.0.3/tests and 1.81887 on output line 557 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.58 on reference line 541 in /build/reproducible-path/mopac-23.0.3/tests and 1.57959 on output line 558 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.50414 on reference line 541 in /build/reproducible-path/mopac-23.0.3/tests and 1.50454 on output line 558 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.02757 on reference line 542 in /build/reproducible-path/mopac-23.0.3/tests and 1.02712 on output line 559 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.74638 on reference line 542 in /build/reproducible-path/mopac-23.0.3/tests and 1.74651 on output line 559 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.93813 on reference line 542 in /build/reproducible-path/mopac-23.0.3/tests and 0.93829 on output line 559 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.20469 on reference line 544 in /build/reproducible-path/mopac-23.0.3/tests and 1.20454 on output line 561 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.9083 on reference line 544 in /build/reproducible-path/mopac-23.0.3/tests and 0.90816 on output line 561 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.17477 on reference line 544 in /build/reproducible-path/mopac-23.0.3/tests and 1.17502 on output line 561 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.14334 on reference line 545 in /build/reproducible-path/mopac-23.0.3/tests and 1.14322 on output line 562 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1.16678 on reference line 546 in /build/reproducible-path/mopac-23.0.3/tests and 1.16721 on output line 563 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.94759 on reference line 546 in /build/reproducible-path/mopac-23.0.3/tests and 0.94721 on output line 563 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.81646 on reference line 547 in /build/reproducible-path/mopac-23.0.3/tests and 0.81667 on output line 564 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 0.81574 on reference line 549 in /build/reproducible-path/mopac-23.0.3/tests and 0.81546 on output line 566 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -1.325 on reference line 567 in /build/reproducible-path/mopac-23.0.3/tests and -1.324 on output line 584 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -6.903 on reference line 567 in /build/reproducible-path/mopac-23.0.3/tests and -6.902 on output line 584 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -4054.5015 on reference line 576 in /build/reproducible-path/mopac-23.0.3/tests and -4054.5055 on output line 593 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 1748.4397 on reference line 577 in /build/reproducible-path/mopac-23.0.3/tests and 1748.4427 on output line 594 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2306.0618 on reference line 579 in /build/reproducible-path/mopac-23.0.3/tests and -2306.0628 on output line 596 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -391.1003 on reference line 583 in /build/reproducible-path/mopac-23.0.3/tests and -391.1013 on output line 600 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -162.9682 on reference line 584 in /build/reproducible-path/mopac-23.0.3/tests and -162.9683 on output line 601 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -554.0685 on reference line 586 in /build/reproducible-path/mopac-23.0.3/tests and -554.0695 on output line 603 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 13473.4859 on reference line 588 in /build/reproducible-path/mopac-23.0.3/tests and 13473.1975 on output line 605 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -27163.3213 on reference line 589 in /build/reproducible-path/mopac-23.0.3/tests and -27162.7311 on output line 606 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 13847.8465 on reference line 590 in /build/reproducible-path/mopac-23.0.3/tests and 13847.5466 on output line 607 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between 158.0111 on reference line 592 in /build/reproducible-path/mopac-23.0.3/tests and 158.0129 on output line 609 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -396.0574 on reference line 594 in /build/reproducible-path/mopac-23.0.3/tests and -396.0566 on output line 611 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +27: WARNING: numerical mismatch between -2702.1191 on reference line 596 in /build/reproducible-path/mopac-23.0.3/tests and -2702.1194 on output line 613 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +120/124 Test #27: erratic-1 ........................ Passed 9.04 sec +114: +114: +114: MOPAC Job: "ROOT.mop" ended normally on Feb 23, 2026, at 23:30. +114: 1: 1: -1: MOPAC Job: "port.mop" ended normally on Jan 20, 2025, at 15:04. +1: MOPAC Job: "port.mop" ended normally on Feb 23, 2026, at 23:30. 1: +114: WARNING: numerical heat mismatch between -205.75414 on reference line 100 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -205.75541 on output line 100 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical mismatch between -860.87533 on reference line 100 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -860.88062 on output line 100 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical heat mismatch between -205.75414 on reference line 740 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -205.75541 on output line 740 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical mismatch between -860.87533 on reference line 740 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -860.88062 on output line 740 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical heat mismatch between -103.23488 on reference line 1380 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -103.2361 on output line 1380 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical mismatch between -431.93475 on reference line 1380 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -431.93982 on output line 1380 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical heat mismatch between -101.79895 on reference line 2020 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -101.80016 on output line 2020 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical mismatch between -425.92679 on reference line 2020 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -425.93185 on output line 2020 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical heat mismatch between -205.75414 on reference line 2660 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -205.75541 on output line 2660 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical mismatch between -860.87533 on reference line 2660 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -860.88062 on output line 2660 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical heat mismatch between 41.89936 on reference line 3300 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 41.89823 on output line 3300 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical mismatch between 175.30693 on reference line 3300 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 175.30219 on output line 3300 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical heat mismatch between -102.57995 on reference line 3940 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -102.58117 on output line 3940 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +114: WARNING: numerical mismatch between -429.19453 on reference line 3940 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -429.1996 on output line 3940 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac +121/124 Test #114: key-ROOT ......................... Passed 14.87 sec 1: WARNING: numerical mismatch between 0.00060287 on reference line 52884 in /build/reproducible-path/mopac-23.0.3/tests and 1.9631 on output line 52887 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 1: WARNING: numerical mismatch between 0.000614315 on reference line 52885 in /build/reproducible-path/mopac-23.0.3/tests and 16.9805 on output line 52888 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 1: WARNING: numerical mismatch between 18.676412 on reference line 52887 in /build/reproducible-path/mopac-23.0.3/tests and 16.980531 on output line 52890 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac @@ -5925,47 +5914,28 @@ 1: WARNING: numerical mismatch between 2.198131 on reference line 103843 in /build/reproducible-path/mopac-23.0.3/tests and 2.198257 on output line 103851 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 1: WARNING: numerical mismatch between 5.8019 on reference line 103843 in /build/reproducible-path/mopac-23.0.3/tests and 5.8017 on output line 103851 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac 1: WARNING: numerical mismatch between 3.39311 on reference line 103843 in /build/reproducible-path/mopac-23.0.3/tests and 3.39299 on output line 103851 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -121/124 Test #1: port ............................. Passed 48.90 sec -114: -114: -114: MOPAC Job: "ROOT.mop" ended normally on Jan 20, 2025, at 15:04. -114: -114: WARNING: numerical heat mismatch between -205.75414 on reference line 100 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -205.75541 on output line 100 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical mismatch between -860.87533 on reference line 100 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -860.88062 on output line 100 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical heat mismatch between -205.75414 on reference line 740 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -205.75541 on output line 740 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical mismatch between -860.87533 on reference line 740 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -860.88062 on output line 740 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical heat mismatch between -103.23488 on reference line 1380 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -103.2361 on output line 1380 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical mismatch between -431.93475 on reference line 1380 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -431.93982 on output line 1380 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical heat mismatch between -101.79895 on reference line 2020 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -101.80016 on output line 2020 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical mismatch between -425.92679 on reference line 2020 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -425.93185 on output line 2020 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical heat mismatch between -205.75414 on reference line 2660 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -205.75541 on output line 2660 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical mismatch between -860.87533 on reference line 2660 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -860.88062 on output line 2660 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical heat mismatch between 41.89936 on reference line 3300 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 41.89823 on output line 3300 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical mismatch between 175.30693 on reference line 3300 in /build/reproducible-path/mopac-23.0.3/tests/keywords and 175.30219 on output line 3300 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical heat mismatch between -102.57995 on reference line 3940 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -102.58117 on output line 3940 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -114: WARNING: numerical mismatch between -429.19453 on reference line 3940 in /build/reproducible-path/mopac-23.0.3/tests/keywords and -429.1996 on output line 3940 in /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/mopac -122/124 Test #114: key-ROOT ......................... Passed 34.57 sec +122/124 Test #1: port ............................. Passed 23.21 sec 3: 3: -3: MOPAC Job: "test_Lewis_for_Proteins.mop" ended normally on Jan 20, 2025, at 15:05. +3: MOPAC Job: "test_Lewis_for_Proteins.mop" ended normally on Feb 23, 2026, at 23:30. 3: -123/124 Test #3: mozyme ........................... Passed 88.20 sec +123/124 Test #3: mozyme ........................... Passed 42.91 sec 2: 2: -2: MOPAC Job: "Crambin_1SCF.mop" ended normally on Jan 20, 2025, at 15:05. +2: MOPAC Job: "Crambin_1SCF.mop" ended normally on Feb 23, 2026, at 23:30. 2: -124/124 Test #2: crambin .......................... Passed 90.11 sec +124/124 Test #2: crambin .......................... Passed 48.34 sec 100% tests passed, 0 tests failed out of 124 -Total Test time (real) = 90.14 sec +Total Test time (real) = 48.36 sec make[1]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' create-stamp debian/debhelper-build-stamp dh_prep debian/rules override_dh_auto_install make[1]: Entering directory '/build/reproducible-path/mopac-23.0.3' dh_auto_install - cd obj-i686-linux-gnu && make -j11 install DESTDIR=/build/reproducible-path/mopac-23.0.3/debian/mopac AM_UPDATE_INFO_DIR=no + cd obj-i686-linux-gnu && make -j21 install DESTDIR=/build/reproducible-path/mopac-23.0.3/debian/mopac AM_UPDATE_INFO_DIR=no make[2]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/mopac-23.0.3 -B/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu//CMakeFiles/progress.marks @@ -6000,22 +5970,22 @@ cd /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3 /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles/mopac-api-test.dir/DependInfo.cmake "--color=" make[4]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' make[4]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -make -f CMakeFiles/mopac.dir/build.make CMakeFiles/mopac.dir/build -make -f CMakeFiles/mopac-param.dir/build.make CMakeFiles/mopac-param.dir/build -make[4]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' make -f CMakeFiles/mopac-api-test.dir/build.make CMakeFiles/mopac-api-test.dir/build +make[4]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' +make -f CMakeFiles/mopac-param.dir/build.make CMakeFiles/mopac-param.dir/build +make -f CMakeFiles/mopac.dir/build.make CMakeFiles/mopac.dir/build make[4]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -make[4]: Nothing to be done for 'CMakeFiles/mopac.dir/build'. +make[4]: Nothing to be done for 'CMakeFiles/mopac-api-test.dir/build'. make[4]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' make[4]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' make[4]: Nothing to be done for 'CMakeFiles/mopac-param.dir/build'. make[4]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' make[4]: Entering directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -make[4]: Nothing to be done for 'CMakeFiles/mopac-api-test.dir/build'. +make[4]: Nothing to be done for 'CMakeFiles/mopac.dir/build'. make[4]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' -[ 98%] Built target mopac -[ 99%] Built target mopac-param +[100%] Built target mopac-param [100%] Built target mopac-api-test +[100%] Built target mopac make[3]: Leaving directory '/build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/mopac-23.0.3/obj-i686-linux-gnu/CMakeFiles 0 make -f CMakeFiles/Makefile2 preinstall @@ -6052,8 +6022,8 @@ dh_gencontrol dh_md5sums dh_builddeb -dpkg-deb: building package 'mopac' in '../mopac_23.0.3-1_i386.deb'. dpkg-deb: building package 'mopac-dbgsym' in '../mopac-dbgsym_23.0.3-1_i386.deb'. +dpkg-deb: building package 'mopac' in '../mopac_23.0.3-1_i386.deb'. dpkg-genbuildinfo --build=binary -O../mopac_23.0.3-1_i386.buildinfo dpkg-genchanges --build=binary -O../mopac_23.0.3-1_i386.changes dpkg-genchanges: info: binary-only upload (no source code included) @@ -6061,12 +6031,14 @@ dpkg-buildpackage: info: binary-only upload (no source included) dpkg-genchanges: info: including full source code in upload I: copying local configuration +I: user script /srv/workspace/pbuilder/94934/tmp/hooks/B01_cleanup starting +I: user script /srv/workspace/pbuilder/94934/tmp/hooks/B01_cleanup finished I: unmounting dev/ptmx filesystem I: unmounting dev/pts filesystem I: unmounting dev/shm filesystem I: unmounting proc filesystem I: unmounting sys filesystem I: cleaning the build env -I: removing directory /srv/workspace/pbuilder/28393 and its subdirectories -I: Current time: Mon Jan 20 15:05:40 -12 2025 -I: pbuilder-time-stamp: 1737428740 +I: removing directory /srv/workspace/pbuilder/94934 and its subdirectories +I: Current time: Mon Feb 23 23:30:40 +14 2026 +I: pbuilder-time-stamp: 1771839040