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	hartrees
Energy at 0K	-476.414940
Energy at 298.15K	-476.418573
HF Energy	-476.331978
Nuclear repulsion energy	91.168405

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3278	3278	12.91
2	A'	3248	3248	1.54
3	A'	3186	3186	2.33
4	A'	2528	2528	34.57
5	A'	1675	1675	30.13
6	A'	1479	1479	10.44
7	A'	1343	1343	3.56
8	A'	1104	1104	24.74
9	A'	884	884	11.32
10	A'	652	652	18.72
11	A'	380	380	3.76
12	A"	1016	1016	34.65
13	A"	945	945	52.27
14	A"	612	612	14.63
15	A"	240	240	28.35

Atom	x (Å)	y (Å)
C1	1.295	1.147
C2	0.000	0.805
S3	-0.697	-0.893
H4	2.097	0.416
H5	1.586	2.192
H6	-0.796	1.541
H7	0.502	-1.568

	C1	C2	S3	H4	H5	H6	H7
C1		1.3387	2.8509	1.0856	1.0849	2.1271	2.8276
C2	1.3387		1.8361	2.1331	2.1062	1.0839	2.4256
S3	2.8509	1.8361		3.0859	3.8377	2.4365	1.3760
H4	1.0856	2.1331	3.0859		1.8482	3.1042	2.5453
H5	1.0849	2.1062	3.8377	1.8482		2.4685	3.9124
H6	2.1271	1.0839	2.4365	3.1042	2.4685		3.3690
H7	2.8276	2.4256	1.3760	2.5453	3.9124	3.3690

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.087	C1	C2	H6	122.465
C2	C1	H4	122.917	C2	C1	H5	120.330
C2	S3	H7	97.035	S3	C2	H6	110.448
H4	C1	H5	116.753

All results from a given calculation for CH₂CHSH (Ethenethiol)

using model chemistry: B2PLYP=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 CH2CHSH (Ethenethiol)

using model chemistry: B2PLYP=FULL/6-31G

States and conformations

All results from a given calculation for CH₂CHSH (Ethenethiol)