Mickaël Véril 31d2640f60 Update outputs		2020-12-04 11:50:04 +01:00
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cc-pvdz	Update outputs	2020-12-04 11:50:04 +01:00
cc-pvtz	update output and new calculation pyridine and pyrimidine	2020-11-08 12:08:44 +01:00