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	hartrees
Energy at 0K	-835.764692
Energy at 298.15K
HF Energy	-835.266016
Nuclear repulsion energy	147.160301

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3194	3194	5.27
2	A	3178	3178	5.74
3	A	3080	3080	16.87
4	A	2704	2704	2.62
5	A	1471	1471	7.06
6	A	1454	1454	7.58
7	A	1346	1346	4.25
8	A	978	978	5.45
9	A	974	974	1.35
10	A	883	883	3.35
11	A	717	717	1.08
12	A	499	499	0.54
13	A	309	309	12.97
14	A	240	240	0.17
15	A	172	172	0.33

Atom	x (Å)	y (Å)	z (Å)
C1	-1.631	0.717	-0.004
S2	-0.501	-0.722	0.012
S3	1.366	0.243	-0.087
H4	1.553	0.408	1.244
H5	-1.454	1.327	-0.898
H6	-2.652	0.308	-0.033
H7	-1.502	1.319	0.905

	C1	S2	S3	H4	H5	H6	H7
C1		1.8298	3.0351	3.4330	1.0973	1.1006	1.0977
S2	1.8298		2.1045	2.6481	2.4369	2.3852	2.4427
S3	3.0351	2.1045		1.3540	3.1281	4.0188	3.2198
H4	3.4330	2.6481	1.3540		3.8044	4.3951	3.2057
H5	1.0973	2.4369	3.1281	3.8044		1.7958	1.8039
H6	1.1006	2.3852	4.0188	4.3951	1.7958		1.7956
H7	1.0977	2.4427	3.2198	3.2057	1.8039	1.7956

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	100.736	S2	C1	H5	110.193
S2	C1	H6	106.286	S2	C1	H7	110.607
S2	S3	H4	97.561	H5	C1	H6	109.582
H5	C1	H7	110.540	H6	C1	H7	109.537

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

using model chemistry: MP3=FULL/aug-cc-pVDZ

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: MP3=FULL/aug-cc-pVDZ

States and conformations

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