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	hartrees
Energy at 0K	-835.608356
Energy at 298.15K
HF Energy	-835.211000
Nuclear repulsion energy	149.124220

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	3235	3048	4.59	53.61	0.75	0.86
2	A	3221	3035	4.07	79.11	0.74	0.85
3	A	3119	2939	13.39	113.93	0.02	0.04
4	A	2738	2579	16.17	146.77	0.33	0.50
5	A	1543	1454	10.14	14.63	0.74	0.85
6	A	1521	1433	9.47	20.83	0.75	0.86
7	A	1436	1353	2.22	6.09	0.44	0.61
8	A	1036	976	7.55	6.25	0.66	0.80
9	A	1032	973	8.62	6.09	0.68	0.81
10	A	934	880	9.89	27.87	0.67	0.80
11	A	751	707	1.19	11.09	0.35	0.52
12	A	534	503	0.54	16.78	0.27	0.42
13	A	324	305	22.64	8.87	0.75	0.86
14	A	248	234	0.14	4.40	0.61	0.76
15	A	184	174	0.69	0.05	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-1.631	0.690	-0.006
S2	-0.480	-0.708	0.016
S3	1.347	0.242	-0.088
H4	1.563	0.456	1.223
H5	-1.472	1.310	-0.888
H6	-2.636	0.262	-0.044
H7	-1.536	1.297	0.896

	C1	S2	S3	H4	H5	H6	H7
C1		1.8106	3.0121	3.4297	1.0902	1.0930	1.0907
S2	1.8106		2.0616	2.6431	2.4232	2.3648	2.4306
S3	3.0121	2.0616		1.3456	3.1186	3.9830	3.2236
H4	3.4297	2.6431	1.3456		3.7940	4.3899	3.2276
H5	1.0902	2.4232	3.1186	3.7940		1.7793	1.7852
H6	1.0930	2.3648	3.9830	4.3899	1.7793		1.7780
H7	1.0907	2.4306	3.2236	3.2276	1.7852	1.7780

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	101.940	S2	C1	H5	110.852
S2	C1	H6	106.430	S2	C1	H7	111.379
S2	S3	H4	99.598	H5	C1	H6	109.175
H5	C1	H7	109.890	H6	C1	H7	109.021

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

using model chemistry: MP2=FULL/6-31G*

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=FULL/6-31G*

States and conformations

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