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	hartrees
Energy at 0K	-835.887928
Energy at 298.15K
HF Energy	-835.313035
Nuclear repulsion energy	149.477088

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3179	3027	5.87
2	A	3165	3013	5.18
3	A	3073	2927	16.86
4	A	2701	2572	3.49
5	A	1502	1430	7.21
6	A	1483	1412	7.68
7	A	1372	1306	3.49
8	A	993	945	5.01
9	A	989	942	2.81
10	A	907	864	4.60
11	A	732	697	1.17
12	A	529	504	0.47
13	A	325	309	13.34
14	A	246	235	0.11
15	A	177	168	0.35

Atom	x (Å)	y (Å)	z (Å)
C1	-1.630	0.688	-0.005
S2	-0.477	-0.707	0.014
S3	1.344	0.243	-0.087
H4	1.540	0.438	1.224
H5	-1.481	1.295	-0.894
H6	-2.631	0.257	-0.025
H7	-1.519	1.296	0.888

	C1	S2	S3	H4	H5	H6	H7
C1		1.8106	3.0084	3.4094	1.0863	1.0896	1.0867
S2	1.8106		2.0560	2.6150	2.4172	2.3607	2.4213
S3	3.0084	2.0560		1.3393	3.1208	3.9753	3.2021
H4	3.4094	2.6150	1.3393		3.7878	4.3574	3.1944
H5	1.0863	2.4172	3.1208	3.7878		1.7758	1.7826
H6	1.0896	2.3607	3.9753	4.3574	1.7758		1.7750
H7	1.0867	2.4213	3.2021	3.1944	1.7826	1.7750

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	101.978	S2	C1	H5	110.607
S2	C1	H6	106.299	S2	C1	H7	110.897
S2	S3	H4	98.534	H5	C1	H6	109.407
H5	C1	H7	110.240	H6	C1	H7	109.298

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

using model chemistry: CCD/cc-pV(T+d)Z

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: CCD/cc-pV(T+d)Z

States and conformations

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