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acetylene_CC3_aug-cc-pVTZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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acetylene_CCSDT_aug-cc-pVTZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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acetylene_CCSDTQ_aug-cc-pVDZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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acetylene_exFCI_aug-cc-pVDZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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acetylene_exFCI_aug-cc-pVTZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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acetylene_TBE.dat
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Add TBE files
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2020-01-29 17:20:34 +01:00 |
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diazomethane_TBE.dat
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Add TBE files
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2020-01-29 17:20:34 +01:00 |
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formaldehyde_CC3_aug-cc-pVTZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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formaldehyde_CCSDT_aug-cc-pVTZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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formaldehyde_CCSDTQ_aug-cc-pVDZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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formaldehyde_exFCI_aug-cc-pVDZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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formaldehyde_exFCI_aug-cc-pVTZ.dat
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Fix # Number Spin Symm comment
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2019-11-17 17:43:01 +01:00 |
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formaldehyde_TBE.dat
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Add TBE files
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2020-01-29 17:20:34 +01:00 |
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ketene_TBE.dat
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Add TBE files
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2020-01-29 17:20:34 +01:00 |
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nitrosomethane_TBE.dat
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Add TBE files
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2020-01-29 17:20:34 +01:00 |
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thioformaldehyde_CC3_aug-cc-pVTZ.dat
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Add thioformaldehyde data
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2019-11-18 11:47:07 +01:00 |
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thioformaldehyde_CCSDT_aug-cc-pVTZ.dat
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Add thioformaldehyde data
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2019-11-18 11:47:07 +01:00 |
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thioformaldehyde_CCSDTQ_aug-cc-pVDZ.dat
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Add thioformaldehyde data
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2019-11-18 11:47:07 +01:00 |
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thioformaldehyde_exFCI_aug-cc-pVDZ.dat
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Add thioformaldehyde data
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2019-11-18 11:47:07 +01:00 |
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thioformaldehyde_exFCI_aug-cc-pVTZ.dat
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Add thioformaldehyde data
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2019-11-18 11:47:07 +01:00 |
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thioformaldehyde_TBE.dat
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Add TBE files
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2020-01-29 17:20:34 +01:00 |
