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	hartrees
Energy at 0K	-835.821684
Energy at 298.15K
HF Energy	-835.298573
Nuclear repulsion energy	150.193105

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A	3192	3011	2.62	50.01	0.75	0.86
2	A	3178	2998	2.94	71.61	0.74	0.85
3	A	3077	2903	14.39	167.80	0.03	0.05
4	A	2709	2556	1.41	138.99	0.23	0.37
5	A	1500	1416	8.13	4.06	0.70	0.82
6	A	1481	1397	9.01	5.35	0.75	0.86
7	A	1363	1286	2.09	0.94	0.12	0.21
8	A	990	934	4.08	1.02	0.10	0.18
9	A	986	930	3.75	0.76	0.13	0.23
10	A	897	846	5.49	8.84	0.47	0.64
11	A	737	695	1.31	12.55	0.23	0.37
12	A	534	504	0.48	11.24	0.12	0.21
13	A	328	309	13.12	0.46	0.73	0.85
14	A	246	232	0.12	4.54	0.53	0.69
15	A	182	172	0.33	0.02	0.51	0.67

Atom	x (Å)	y (Å)	z (Å)
C1	-1.624	0.684	-0.006
S2	-0.472	-0.703	0.015
S3	1.336	0.242	-0.087
H4	1.534	0.446	1.222
H5	-1.466	1.296	-0.889
H6	-2.623	0.249	-0.038
H7	-1.521	1.286	0.893

	C1	S2	S3	H4	H5	H6	H7
C1		1.8031	2.9933	3.3962	1.0865	1.0897	1.0867
S2	1.8031		2.0425	2.6079	2.4091	2.3525	2.4141
S3	2.9933	2.0425		1.3398	3.0991	3.9585	3.1955
H4	3.3962	2.6079	1.3398		3.7656	4.3476	3.1851
H5	1.0865	2.4091	3.0991	3.7656		1.7771	1.7834
H6	1.0897	2.3525	3.9585	4.3476	1.7771		1.7763
H7	1.0867	2.4141	3.1955	3.1851	1.7834	1.7763

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	102.046	S2	C1	H5	110.501
S2	C1	H6	106.192	S2	C1	H7	110.868
S2	S3	H4	98.769	H5	C1	H6	109.494
H5	C1	H7	110.294	H6	C1	H7	109.398

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

using model chemistry: MP2/6-311+G(3df,2p)

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: MP2/6-311+G(3df,2p)

States and conformations

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