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	hartrees
Energy at 0K	-473.610597
Energy at 298.15K	-473.614309
HF Energy	-473.266335
Nuclear repulsion energy	92.839872

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3254	3254	9.72
2	A'	3204	3204	2.62
3	A'	3171	3171	2.65
4	A'	2750	2750	7.62
5	A'	1685	1685	17.39
6	A'	1513	1513	7.17
7	A'	1375	1375	0.79
8	A'	1150	1150	21.06
9	A'	960	960	8.71
10	A'	699	699	13.44
11	A'	403	403	3.47
12	A"	1024	1024	27.05
13	A"	937	937	49.85
14	A"	619	619	13.78
15	A"	243	243	21.28

Atom	x (Å)	y (Å)
C1	1.298	1.098
C2	0.000	0.774
S3	-0.699	-0.859
H4	2.088	0.352
H5	1.612	2.137
H6	-0.769	1.541
H7	0.467	-1.523

	C1	C2	S3	H4	H5	H6	H7
C1		1.3379	2.7959	1.0871	1.0856	2.1142	2.7498
C2	1.3379		1.7755	2.1303	2.1115	1.0868	2.3432
S3	2.7959	1.7755		3.0386	3.7837	2.4006	1.3416
H4	1.0871	2.1303	3.0386		1.8481	3.0952	2.4786
H5	1.0856	2.1115	3.7837	1.8481		2.4549	3.8352
H6	2.1142	1.0868	2.4006	3.0952	2.4549		3.3037
H7	2.7498	2.3432	1.3416	2.4786	3.8352	3.3037

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.235	C1	C2	H6	121.026
C2	C1	H4	122.580	C2	C1	H5	120.862
C2	S3	H7	96.489	S3	C2	H6	111.739
H4	C1	H5	116.558

All results from a given calculation for CH₂CHSH (Ethenethiol)

using model chemistry: MP3=FULL/3-21G*

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=FULL/3-21G*

States and conformations

All results from a given calculation for CH₂CHSH (Ethenethiol)