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	hartrees
Energy at 0K	-476.047299
Energy at 298.15K	-476.050864
HF Energy	-475.594731
Nuclear repulsion energy	93.132312

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3304	3090	9.14
2	A'	3250	3039	2.91
3	A'	3211	3003	2.64
4	A'	2761	2582	5.71
5	A'	1698	1588	33.04
6	A'	1466	1371	8.62
7	A'	1337	1250	2.10
8	A'	1103	1032	24.03
9	A'	920	860	6.13
10	A'	712	666	16.08
11	A'	386	361	3.97
12	A"	980	916	36.93
13	A"	768	718	38.45
14	A"	557	521	9.33
15	A"	214	200	13.82

Atom	x (Å)	y (Å)
C1	1.288	1.103
C2	0.000	0.772
S3	-0.693	-0.861
H4	2.076	0.363
H5	1.581	2.142
H6	-0.769	1.533
H7	0.476	-1.517

	C1	C2	S3	H4	H5	H6	H7
C1		1.3293	2.7889	1.0811	1.0797	2.1006	2.7427
C2	1.3293		1.7739	2.1158	2.0919	1.0812	2.3382
S3	2.7889	1.7739		3.0272	3.7666	2.3945	1.3404
H4	1.0811	2.1158	3.0272		1.8462	3.0756	2.4688
H5	1.0797	2.0919	3.7666	1.8462		2.4276	3.8222
H6	2.1006	1.0812	2.3945	3.0756	2.4276		3.2938
H7	2.7427	2.3382	1.3404	2.4688	3.8222	3.2938

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.397	C1	C2	H6	120.907
C2	C1	H4	122.420	C2	C1	H5	120.189
C2	S3	H7	96.321	S3	C2	H6	111.697
H4	C1	H5	117.392

All results from a given calculation for CH₂CHSH (Ethenethiol)

using model chemistry: MP3/TZVP

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 CH2CHSH (Ethenethiol)

using model chemistry: MP3/TZVP

States and conformations

All results from a given calculation for CH₂CHSH (Ethenethiol)