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	hartrees
Energy at 0K	-836.246980
Energy at 298.15K
HF Energy	-835.298458
Nuclear repulsion energy	149.436794

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3164	3164
2	A	3147	3147
3	A	3058	3058
4	A	2648	2648
5	A	1493	1493
6	A	1477	1477
7	A	1362	1362
8	A	982	982
9	A	979	979
10	A	880	880
11	A	719	719
12	A	515	515
13	A	312	312
14	A	240	240
15	A	168	168

Atom	x (Å)	y (Å)	z (Å)
C1	-1.628	0.690	-0.006
S2	-0.478	-0.707	0.015
S3	1.344	0.243	-0.087
H4	1.539	0.441	1.227
H5	-1.473	1.297	-0.894
H6	-2.630	0.260	-0.029
H7	-1.516	1.296	0.891

	C1	S2	S3	H4	H5	H6	H7
C1		1.8104	3.0067	3.4080	1.0871	1.0906	1.0875
S2	1.8104		2.0570	2.6188	2.4155	2.3604	2.4201
S3	3.0067	2.0570		1.3435	3.1139	3.9746	3.2002
H4	3.4080	2.6188	1.3435		3.7819	4.3584	3.1897
H5	1.0871	2.4155	3.1139	3.7819		1.7785	1.7851
H6	1.0906	2.3604	3.9746	4.3584	1.7785		1.7779
H7	1.0875	2.4201	3.2002	3.1897	1.7851	1.7779

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	101.866	S2	C1	H5	110.451
S2	C1	H6	106.245	S2	C1	H7	110.774
S2	S3	H4	98.548	H5	C1	H6	109.507
H5	C1	H7	110.345	H6	C1	H7	109.427

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

using model chemistry: QCISD(T)=FULL/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: QCISD(T)=FULL/6-311+G(3df,2p)

States and conformations

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