Mickaël Véril 9cdb57208f Fix dimethylaniline.xyz geometry ... Geometries must be in Angstrom. Thanks to Christof Holzer for pointing out this error!		2022-05-27 13:52:42 +02:00
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aminobenzonitrile.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
aniline.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
azulene.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
benzonitrile.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
benzothiadiazole.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
beta-dipeptide.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
dimethylaminobenzonitrile.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
dimethylaniline.xyz	Fix dimethylaniline.xyz geometry	2022-05-27 13:52:42 +02:00
dipeptide.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
hydrogen_chloride.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
n-phenylpyrrole.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
nitroaniline.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
nitrobenzene.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
nitrodimethylaniline.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
nitropyridine_n-oxide.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
phthalazine.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
quinoxaline.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
twisted_dmabn.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00
twisted_pp.xyz	Add data from QUEST#6 main paper	2021-12-06 09:32:00 +01:00