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CCSDT
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MP5 and CCSD(T)
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2020-11-04 09:24:53 +01:00 |
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CRCC
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Added GAMESS files
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2021-07-26 17:07:27 +02:00 |
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CRCC23
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Added GAMESS files
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2021-07-26 17:07:27 +02:00 |
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MP5
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MP5
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2020-11-06 00:00:20 +01:00 |
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benzene_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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benzene_opt.fci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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benzene_opt.fci4.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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benzene_opt.fci5.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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benzene_opt.fci6.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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benzene_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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benzene.fci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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benzene.locfci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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benzene.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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benzene.nofci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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benzene.nofci.out
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2021-06-21 14:01:29 +02:00 |
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benzene.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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cycle_5.tgz
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input and output Denis
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2020-12-09 08:33:28 +01:00 |
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cycle_6.tgz
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input and output Denis
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2020-12-09 08:33:28 +01:00 |
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cyclopentadiene_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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cyclopentadiene_opt.fci4.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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cyclopentadiene_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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cyclopentadiene.fci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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cyclopentadiene.locfci.out
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2021-06-21 14:01:29 +02:00 |
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cyclopentadiene.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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cyclopentadiene.nofci.out
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2021-06-21 14:01:29 +02:00 |
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cyclopentadiene.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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furan_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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furan_opt.fci4.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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furan_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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furan.fci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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furan.locfci.out
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2021-06-21 14:01:29 +02:00 |
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furan.nofci2.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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furan.nofci.out
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2021-06-21 14:01:29 +02:00 |
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furan.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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imidazole_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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imidazole_opt.fci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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imidazole_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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imidazole.fci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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imidazole.locfci.out
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2021-06-21 14:01:29 +02:00 |
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imidazole.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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imidazole.nofci.out
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2021-06-21 14:01:29 +02:00 |
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imidazole.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyrazine_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyrazine_opt.fci4.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyrazine_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyrazine.fci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyrazine.locfci.out
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2021-06-21 14:01:29 +02:00 |
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pyrazine.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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pyrazine.nofci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyrazine.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyridazine_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyridazine_opt.fci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyridazine_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyridazine.fci.out
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2021-06-21 14:01:29 +02:00 |
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pyridazine.locfci.out
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2021-06-21 14:01:29 +02:00 |
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pyridazine.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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pyridazine.nofci.out
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2021-06-21 14:01:29 +02:00 |
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pyridazine.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyridine_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyridine_opt.fci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyridine_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyridine.fci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyridine.locfci.out
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2021-06-21 14:01:29 +02:00 |
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pyridine.nofci2.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyridine.nofci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyridine.nofci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyridine.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyrimidine_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyrimidine_opt.fci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyrimidine_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyrimidine.fci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyrimidine.locfci.out
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2021-06-21 14:01:29 +02:00 |
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pyrimidine.nofci2.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyrimidine.nofci.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyrimidine.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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pyrrole_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyrrole_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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pyrrole.fci.out
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2021-06-21 14:01:29 +02:00 |
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pyrrole.locfci.out
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2021-06-21 14:01:29 +02:00 |
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pyrrole.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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pyrrole.nofci.out
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2021-06-21 14:01:29 +02:00 |
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pyrrole.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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tetrazine_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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tetrazine_opt.fci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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tetrazine_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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tetrazine.fc.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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tetrazine.fci.out
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2021-06-21 14:01:29 +02:00 |
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tetrazine.help.out
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2021-06-21 14:01:29 +02:00 |
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tetrazine.locfci.out
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2021-06-21 14:01:29 +02:00 |
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tetrazine.natorb.out
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2021-06-21 14:01:29 +02:00 |
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tetrazine.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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tetrazine.nofci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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tetrazine.nofci.out
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2021-06-21 14:01:29 +02:00 |
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tetrazine.scf.out
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2021-06-21 14:01:29 +02:00 |
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tetrazine.slaves.out
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2021-06-21 14:01:29 +02:00 |
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thiophene_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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thiophene_opt.fci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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thiophene_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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thiophene.fci.out
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2021-06-21 14:01:29 +02:00 |
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thiophene.locfci.out
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2021-06-21 14:01:29 +02:00 |
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thiophene.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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thiophene.nofci.out
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2021-06-21 14:01:29 +02:00 |
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thiophene.scf.out
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Added outputs in output
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2021-06-21 14:01:29 +02:00 |
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triazine_opt.fci2.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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triazine_opt.fci3.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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triazine_opt.fci.out
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Outputs
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2021-07-30 11:29:51 +02:00 |
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triazine.fci.out
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2021-06-21 14:01:29 +02:00 |
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triazine.locfci.out
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2021-06-21 14:01:29 +02:00 |
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triazine.nofci2.out
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2021-06-21 14:01:29 +02:00 |
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triazine.nofci.out
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triazine.scf.out
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