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	hartrees
Energy at 0K	-476.043027
Energy at 298.15K	-476.046663
HF Energy	-475.588558
Nuclear repulsion energy	93.096916

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3267	3121	9.57
2	A'	3207	3063	4.26
3	A'	3173	3031	2.87
4	A'	2768	2644	5.83
5	A'	1686	1611	25.69
6	A'	1450	1385	7.56
7	A'	1326	1266	1.66
8	A'	1103	1054	26.95
9	A'	928	886	5.85
10	A'	722	689	14.48
11	A'	384	366	3.96
12	A"	995	951	27.97
13	A"	874	835	37.43
14	A"	590	564	14.18
15	A"	223	213	15.68

Atom	x (Å)	y (Å)
C1	1.294	1.100
C2	0.000	0.766
S3	-0.696	-0.857
H4	2.086	0.355
H5	1.588	2.144
H6	-0.769	1.535
H7	0.469	-1.514

	C1	C2	S3	H4	H5	H6	H7
C1		1.3367	2.7915	1.0866	1.0852	2.1085	2.7405
C2	1.3367		1.7664	2.1260	2.1027	1.0872	2.3277
S3	2.7915	1.7664		3.0348	3.7720	2.3935	1.3378
H4	1.0866	2.1260	3.0348		1.8573	3.0888	2.4709
H5	1.0852	2.1027	3.7720	1.8573		2.4341	3.8253
H6	2.1085	1.0872	2.3935	3.0888	2.4341		3.2906
H7	2.7405	2.3277	1.3378	2.4709	3.8253	3.2906

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.659	C1	C2	H6	120.542
C2	C1	H4	122.300	C2	C1	H5	120.138
C2	S3	H7	96.173	S3	C2	H6	111.800
H4	C1	H5	117.563

All results from a given calculation for CH₂CHSH (Ethenethiol)

using model chemistry: CCD/6-311G**

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: CCD/6-311G**

States and conformations

All results from a given calculation for CH₂CHSH (Ethenethiol)