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	hartrees
Energy at 0K	-835.809161
Energy at 298.15K
HF Energy	-835.313070
Nuclear repulsion energy	150.186235

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3246	3246	6.14
2	A	3230	3230	5.47
3	A	3141	3141	17.77
4	A	2781	2781	3.09
5	A	1541	1541	7.60
6	A	1521	1521	8.08
7	A	1412	1412	3.80
8	A	1021	1021	6.03
9	A	1016	1016	2.12
10	A	936	936	5.17
11	A	753	753	1.12
12	A	549	549	0.53
13	A	334	334	14.40
14	A	253	253	0.10
15	A	181	181	0.37

Atom	x (Å)	y (Å)	z (Å)
C1	-1.630	0.680	-0.006
S2	-0.472	-0.701	0.015
S3	1.339	0.242	-0.087
H4	1.540	0.444	1.214
H5	-1.487	1.284	-0.890
H6	-2.622	0.244	-0.024
H7	-1.524	1.287	0.882

	C1	S2	S3	H4	H5	H6	H7
C1		1.8021	3.0018	3.4041	1.0806	1.0839	1.0810
S2	1.8021		2.0443	2.6069	2.4064	2.3485	2.4108
S3	3.0018	2.0443		1.3318	3.1175	3.9612	3.1981
H4	3.4041	2.6069	1.3318		3.7810	4.3464	3.1948
H5	1.0806	2.4064	3.1175	3.7810		1.7662	1.7729
H6	1.0839	2.3485	3.9612	4.3464	1.7662		1.7652
H7	1.0810	2.4108	3.1981	3.1948	1.7729	1.7652

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	102.419	S2	C1	H5	110.681
S2	C1	H6	106.248	S2	C1	H7	110.993
S2	S3	H4	98.908	H5	C1	H6	109.369
H5	C1	H7	110.205	H6	C1	H7	109.249

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

using model chemistry: CISD/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: CISD/cc-pCVTZ

States and conformations

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