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	hartrees
Energy at 0K	-835.912915
Energy at 298.15K
HF Energy	-835.262986
Nuclear repulsion energy	149.014643

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	3203	3034	5.63	58.34	0.75	0.86
2	A	3190	3022	5.34	87.93	0.73	0.85
3	A	3090	2927	18.31	134.83	0.02	0.03
4	A	2649	2509	11.14	150.71	0.31	0.47
5	A	1515	1435	12.54	10.93	0.75	0.86
6	A	1497	1418	10.84	12.75	0.75	0.86
7	A	1424	1349	0.95	2.11	0.73	0.84
8	A	1029	974	7.96	2.97	0.72	0.84
9	A	1024	970	13.73	3.17	0.57	0.73
10	A	922	873	6.98	17.25	0.62	0.76
11	A	748	709	1.61	11.97	0.36	0.53
12	A	512	485	0.76	18.97	0.30	0.46
13	A	317	301	24.50	9.62	0.75	0.86
14	A	250	236	0.24	3.08	0.66	0.80
15	A	200	190	0.86	0.02	0.68	0.81

Atom	x (Å)	y (Å)	z (Å)
C1	-1.613	0.702	-0.005
S2	-0.491	-0.713	0.015
S3	1.346	0.240	-0.088
H4	1.564	0.437	1.227
H5	-1.443	1.320	-0.885
H6	-2.627	0.297	-0.042
H7	-1.506	1.306	0.895

	C1	S2	S3	H4	H5	H6	H7
C1		1.8061	2.9968	3.4181	1.0888	1.0918	1.0895
S2	1.8061		2.0721	2.6483	2.4182	2.3633	2.4256
S3	2.9968	2.0721		1.3468	3.0959	3.9737	3.2001
H4	3.4181	2.6483	1.3468		3.7795	4.3810	3.2082
H5	1.0888	2.4182	3.0959	3.7795		1.7765	1.7814
H6	1.0918	2.3633	3.9737	4.3810	1.7765		1.7758
H7	1.0895	2.4256	3.2001	3.2082	1.7814	1.7758

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	100.979	S2	C1	H5	110.858
S2	C1	H6	106.673	S2	C1	H7	111.383
S2	S3	H4	99.346	H5	C1	H6	109.111
H5	C1	H7	109.732	H6	C1	H7	109.000

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

using model chemistry: MP2=FULL/6-311G*

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/6-311G*

States and conformations

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