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	hartrees
Energy at 0K	-476.162773
Energy at 298.15K	-476.166445
HF Energy	-475.612698
Nuclear repulsion energy	93.265617

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3256	3134	5.67
2	A'	3198	3077	1.97
3	A'	3165	3046	1.95
4	A'	2719	2617	1.10
5	A'	1672	1609	34.21
6	A'	1443	1389	7.91
7	A'	1318	1269	2.00
8	A'	1094	1053	19.40
9	A'	907	873	4.24
10	A'	711	685	14.48
11	A'	377	363	3.78
12	A"	993	956	19.83
13	A"	902	868	37.91
14	A"	599	576	14.55
15	A"	250	241	10.23

Atom	x (Å)	y (Å)
C1	1.292	1.096
C2	0.000	0.767
S3	-0.695	-0.855
H4	2.076	0.351
H5	1.586	2.136
H6	-0.766	1.533
H7	0.468	-1.523

	C1	C2	S3	H4	H5	H6	H7
C1		1.3330	2.7843	1.0821	1.0809	2.1034	2.7458
C2	1.3330		1.7648	2.1176	2.0947	1.0827	2.3380
S3	2.7843	1.7648		3.0217	3.7612	2.3889	1.3411
H4	1.0821	2.1176	3.0217		1.8518	3.0780	2.4693
H5	1.0809	2.0947	3.7612	1.8518		2.4274	3.8264
H6	2.1034	1.0827	2.3889	3.0780	2.4274		3.2958
H7	2.7458	2.3380	1.3411	2.4693	3.8264	3.2958

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.454	C1	C2	H6	120.729
C2	C1	H4	122.180	C2	C1	H5	120.045
C2	S3	H7	96.711	S3	C2	H6	111.817
H4	C1	H5	117.776

All results from a given calculation for CH₂CHSH (Ethenethiol)

using model chemistry: QCISD/aug-cc-pVTZ

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: QCISD/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂CHSH (Ethenethiol)