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	hartrees
Energy at 0K	-835.679398
Energy at 298.15K
HF Energy	-835.217159
Nuclear repulsion energy	141.429659

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3131	3005
2	A	2758	2647
3	A	1476	1417
4	A	1234	1185
5	A	940	902
6	A	657	631
7	A	322	309
8	A	249	239
9	B	3193	3064
10	B	2757	2646
11	B	1322	1269
12	B	1047	1005
13	B	786	754
14	B	748	718
15	B	276	265

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.784
S2	0.000	1.547	-0.181
S3	0.000	-1.547	-0.181
H4	0.878	-0.058	1.427
H5	-0.878	0.058	1.427
H6	1.101	1.267	-0.886
H7	-1.101	-1.267	-0.886

	C1	S2	S3	H4	H5	H6	H7
C1		1.8234	1.8234	1.0900	1.0900	2.3680	2.3680
S2	1.8234		3.0947	2.4356	2.3608	1.3370	3.1036
S3	1.8234	3.0947		2.3608	2.4356	3.1036	1.3370
H4	1.0900	2.4356	2.3608		1.7604	2.6751	3.2755
H5	1.0900	2.3608	2.4356	1.7604		3.2755	2.6751
H6	2.3680	1.3370	3.1036	2.6751	3.2755		3.3573
H7	2.3680	3.1036	1.3370	3.2755	2.6751	3.3573

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	H6	95.827	C1	S3	H7	95.827
S2	C1	S3	116.122	S2	C1	H4	110.925
S2	C1	H5	105.479	S3	C1	H4	105.479
S3	C1	H5	110.925	H4	C1	H5	107.715

All results from a given calculation for HSCH₂SH (Methanedithiol)

using model chemistry: CCSD(T)/6-31+G**

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for HSCH2SH (Methanedithiol)

using model chemistry: CCSD(T)/6-31+G**

States and conformations

All results from a given calculation for HSCH₂SH (Methanedithiol)