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	hartrees
Energy at 0K	-835.358276
Energy at 298.15K
HF Energy	-835.118248
Nuclear repulsion energy	138.891672

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3179	3050	8.59
2	A	3161	3033	5.18
3	A	3062	2938	14.30
4	A	2420	2322	48.00
5	A	1527	1465	10.49
6	A	1508	1447	10.53
7	A	1414	1356	4.06
8	A	1008	968	4.51
9	A	1007	966	7.54
10	A	790	758	3.27
11	A	653	626	0.53
12	A	403	387	0.16
13	A	237	227	27.06
14	A	206	198	0.70
15	A	149	143	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-1.701	0.786	-0.000
S2	-0.582	-0.755	0.009
S3	1.476	0.241	-0.088
H4	1.681	0.351	1.281
H5	-1.490	1.391	-0.889
H6	-2.730	0.403	-0.038
H7	-1.550	1.371	0.914

	C1	S2	S3	H4	H5	H6	H7
C1		1.9045	3.2244	3.6423	1.0955	1.0989	1.0960
S2	1.9045		2.2887	2.8220	2.4974	2.4404	2.5050
S3	3.2244	2.2887		1.3889	3.2804	4.2093	3.3817
H4	3.6423	2.8220	1.3889		3.9806	4.6041	3.4073
H5	1.0955	2.4974	3.2804	3.9806		1.7995	1.8046
H6	1.0989	2.4404	4.2093	4.6041	1.7995		1.7993
H7	1.0960	2.5050	3.3817	3.4073	1.8046	1.7993

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	S2	S3	100.117	S2	C1	H5	109.745
S2	C1	H6	105.530	S2	C1	H7	110.277
S2	S3	H4	97.196	H5	C1	H6	110.169
H5	C1	H7	110.863	H6	C1	H7	110.126

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

using model chemistry: CCD/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: CCD/6-31G

States and conformations

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