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	hartrees
Energy at 0K	-835.679223
Energy at 298.15K
HF Energy	-835.215577
Nuclear repulsion energy	142.003881

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3197	3197	9.43
2	A	2824	2824	3.72
3	A	1522	1522	1.22
4	A	1270	1270	1.28
5	A	958	958	4.65
6	A	675	675	3.14
7	A	316	316	17.68
8	A	250	250	4.50
9	B	3260	3260	1.81
10	B	2824	2824	9.55
11	B	1344	1344	22.91
12	B	1065	1065	33.17
13	B	815	815	17.10
14	B	750	750	0.57
15	B	263	263	38.72

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.778
S2	0.000	1.542	-0.179
S3	0.000	-1.542	-0.179
H4	0.873	-0.051	1.418
H5	-0.873	0.051	1.418
H6	1.097	1.269	-0.881
H7	-1.097	-1.269	-0.881

	C1	S2	S3	H4	H5	H6	H7
C1		1.8151	1.8151	1.0844	1.0844	2.3591	2.3591
S2	1.8151		3.0847	2.4197	2.3533	1.3311	3.0981
S3	1.8151	3.0847		2.3533	2.4197	3.0981	1.3311
H4	1.0844	2.4197	2.3533		1.7500	2.6607	3.2639
H5	1.0844	2.3533	2.4197	1.7500		3.2639	2.6607
H6	2.3591	1.3311	3.0981	2.6607	3.2639		3.3547
H7	2.3591	3.0981	1.3311	3.2639	2.6607	3.3547

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	H6	95.924	C1	S3	H7	95.924
S2	C1	S3	116.362	S2	C1	H4	110.590
S2	C1	H5	105.734	S3	C1	H4	105.734
S3	C1	H5	110.590	H4	C1	H5	107.589

All results from a given calculation for HSCH₂SH (Methanedithiol)

using model chemistry: MP3=FULL/6-31G**

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: MP3=FULL/6-31G**

States and conformations

All results from a given calculation for HSCH₂SH (Methanedithiol)