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	hartrees
Energy at 0K	-835.893777
Energy at 298.15K
HF Energy	-835.312835
Nuclear repulsion energy	149.352130

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3168	3168	6.41
2	A	3153	3153	5.84
3	A	3064	3064	18.11
4	A	2688	2688	4.46
5	A	1500	1500	7.10
6	A	1480	1480	7.50
7	A	1367	1367	3.97
8	A	990	990	4.82
9	A	986	986	2.72
10	A	902	902	4.79
11	A	726	726	1.15
12	A	526	526	0.49
13	A	325	325	13.21
14	A	245	245	0.10
15	A	175	175	0.34

Atom	x (Å)	y (Å)	z (Å)
C1	-1.633	0.688	-0.006
S2	-0.477	-0.707	0.015
S3	1.345	0.243	-0.087
H4	1.541	0.441	1.225
H5	-1.484	1.295	-0.895
H6	-2.633	0.256	-0.025
H7	-1.521	1.297	0.888

	C1	S2	S3	H4	H5	H6	H7
C1		1.8124	3.0120	3.4132	1.0868	1.0902	1.0873
S2	1.8124		2.0574	2.6183	2.4187	2.3621	2.4231
S3	3.0120	2.0574		1.3409	3.1241	3.9788	3.2057
H4	3.4132	2.6183	1.3409		3.7910	4.3616	3.1976
H5	1.0868	2.4187	3.1241	3.7910		1.7772	1.7837
H6	1.0902	2.3621	3.9788	4.3616	1.7772		1.7763
H7	1.0873	2.4231	3.2057	3.1976	1.7837	1.7763

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	102.034	S2	C1	H5	110.574
S2	C1	H6	106.262	S2	C1	H7	110.878
S2	S3	H4	98.596	H5	C1	H6	109.446
H5	C1	H7	110.256	H6	C1	H7	109.332

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

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

States and conformations

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