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	hartrees
Energy at 0K	-835.627853
Energy at 298.15K
HF Energy	-835.210627
Nuclear repulsion energy	148.323302

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3187	3035	7.72
2	A	3173	3021	6.83
3	A	3083	2936	18.19
4	A	2671	2544	24.93
5	A	1529	1456	9.27
6	A	1509	1437	8.51
7	A	1425	1357	3.01
8	A	1027	978	8.95
9	A	1023	974	5.21
10	A	925	881	9.88
11	A	737	702	0.94
12	A	520	495	0.52
13	A	314	299	20.18
14	A	247	235	0.11
15	A	179	170	0.61

Atom	x (Å)	y (Å)	z (Å)
C1	-1.638	0.695	-0.005
S2	-0.484	-0.712	0.015
S3	1.355	0.243	-0.088
H4	1.567	0.449	1.231
H5	-1.482	1.313	-0.894
H6	-2.647	0.269	-0.036
H7	-1.536	1.306	0.896

	C1	S2	S3	H4	H5	H6	H7
C1		1.8197	3.0278	3.4441	1.0932	1.0960	1.0938
S2	1.8197		2.0749	2.6520	2.4338	2.3756	2.4402
S3	3.0278	2.0749		1.3517	3.1373	4.0026	3.2331
H4	3.4441	2.6520	1.3517		3.8157	4.4044	3.2365
H5	1.0932	2.4338	3.1373	3.8157		1.7843	1.7903
H6	1.0960	2.3756	4.0026	4.4044	1.7843		1.7832
H7	1.0938	2.4402	3.2331	3.2365	1.7903	1.7832

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	101.854	S2	C1	H5	110.864
S2	C1	H6	106.471	S2	C1	H7	111.308
S2	S3	H4	99.242	H5	C1	H6	109.183
H5	C1	H7	109.885	H6	C1	H7	109.039

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

using model chemistry: QCISD/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 CH3SSH (Hydrogen methyl disulfide)

using model chemistry: QCISD/6-31G*

States and conformations

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