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	hartrees
Energy at 0K	-835.650435
Energy at 298.15K
HF Energy	-835.221491
Nuclear repulsion energy	149.284747

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A	3251	3053	4.87	59.25	0.75	0.86
2	A	3239	3042	4.95	82.70	0.72	0.84
3	A	3131	2940	18.32	134.61	0.02	0.03
4	A	2788	2619	8.51	144.26	0.30	0.46
5	A	1518	1426	10.50	8.39	0.70	0.82
6	A	1489	1399	8.97	12.84	0.75	0.86
7	A	1422	1335	2.08	2.55	0.75	0.86
8	A	1021	959	7.27	3.15	0.31	0.48
9	A	1013	952	3.36	2.17	0.66	0.79
10	A	925	868	12.12	20.59	0.59	0.74
11	A	748	702	1.24	13.82	0.33	0.49
12	A	530	497	0.59	17.46	0.20	0.33
13	A	299	281	19.98	0.80	0.72	0.84
14	A	247	232	0.13	4.40	0.57	0.72
15	A	177	167	1.08	0.16	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-1.626	0.692	-0.007
S2	-0.482	-0.709	0.016
S3	1.347	0.241	-0.087
H4	1.546	0.460	1.215
H5	-1.458	1.314	-0.881
H6	-2.628	0.270	-0.056
H7	-1.539	1.291	0.895

	C1	S2	S3	H4	H5	H6	H7
C1		1.8088	3.0080	3.4068	1.0860	1.0885	1.0865
S2	1.8088		2.0628	2.6295	2.4183	2.3599	2.4270
S3	3.0080	2.0628		1.3350	3.1063	3.9751	3.2239
H4	3.4068	2.6295	1.3350		3.7608	4.3671	3.2103
H5	1.0860	2.4183	3.1063	3.7608		1.7722	1.7782
H6	1.0885	2.3599	3.9751	4.3671	1.7722		1.7707
H7	1.0865	2.4270	3.2239	3.2103	1.7782	1.7707

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	101.760	S2	C1	H5	110.828
S2	C1	H6	106.415	S2	C1	H7	111.465
S2	S3	H4	99.162	H5	C1	H6	109.167
H5	C1	H7	109.866	H6	C1	H7	109.004

All results from a given calculation for CH₃SSH (Hydrogen methyl disulfide)

using model chemistry: MP2=FULL/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 CH3SSH (Hydrogen methyl disulfide)

using model chemistry: MP2=FULL/6-31+G**

States and conformations

All results from a given calculation for CH₃SSH (Hydrogen methyl disulfide)