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	hartrees
Energy at 0K	-835.807462
Energy at 298.15K
HF Energy	-835.313067
Nuclear repulsion energy	150.202896

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3251	3251	5.87
2	A	3236	3236	5.17
3	A	3145	3145	17.30
4	A	2786	2786	2.81
5	A	1541	1541	7.66
6	A	1522	1522	8.17
7	A	1413	1413	3.63
8	A	1021	1021	6.03
9	A	1017	1017	2.19
10	A	937	937	5.13
11	A	755	755	1.12
12	A	548	548	0.53
13	A	332	332	14.44
14	A	253	253	0.10
15	A	180	180	0.37

Atom	x (Å)	y (Å)	z (Å)
C1	-1.629	0.681	-0.005
S2	-0.472	-0.701	0.015
S3	1.339	0.242	-0.087
H4	1.540	0.440	1.214
H5	-1.485	1.285	-0.889
H6	-2.621	0.246	-0.025
H7	-1.523	1.286	0.883

	C1	S2	S3	H4	H5	H6	H7
C1		1.8016	3.0008	3.4036	1.0802	1.0835	1.0806
S2	1.8016		2.0446	2.6060	2.4057	2.3480	2.4097
S3	3.0008	2.0446		1.3313	3.1157	3.9602	3.1967
H4	3.4036	2.6060	1.3313		3.7801	4.3457	3.1944
H5	1.0802	2.4057	3.1157	3.7801		1.7656	1.7725
H6	1.0835	2.3480	3.9602	4.3457	1.7656		1.7646
H7	1.0806	2.4097	3.1967	3.1944	1.7725	1.7646

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	102.373	S2	C1	H5	110.686
S2	C1	H6	106.263	S2	C1	H7	110.966
S2	S3	H4	98.861	H5	C1	H6	109.364
H5	C1	H7	110.222	H6	C1	H7	109.244

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

using model chemistry: CID/cc-pCVTZ

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: CID/cc-pCVTZ

States and conformations

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