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	hartrees
Energy at 0K	-476.278848
Energy at 298.15K	-476.282564
HF Energy	-475.621398
Nuclear repulsion energy	93.917832

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3300	3159	2.75
2	A'	3227	3088	1.76
3	A'	3198	3061	1.11
4	A'	2752	2634	0.03
5	A'	1656	1585	35.99
6	A'	1440	1378	8.37
7	A'	1309	1253	1.37
8	A'	1090	1044	21.74
9	A'	902	863	4.79
10	A'	727	696	16.30
11	A'	381	364	4.08
12	A"	1004	961	20.07
13	A"	895	857	40.48
14	A"	612	585	14.88
15	A"	276	264	11.39

Atom	x (Å)	y (Å)
C1	1.290	1.082
C2	0.000	0.759
S3	-0.693	-0.845
H4	2.065	0.334
H5	1.583	2.117
H6	-0.758	1.526
H7	0.465	-1.506

	C1	C2	S3	H4	H5	H6	H7
C1		1.3295	2.7645	1.0774	1.0760	2.0955	2.7162
C2	1.3295		1.7468	2.1086	2.0857	1.0789	2.3122
S3	2.7645	1.7468		2.9997	3.7351	2.3719	1.3338
H4	1.0774	2.1086	2.9997		1.8472	3.0649	2.4388
H5	1.0760	2.0857	3.7351	1.8472		2.4143	3.7918
H6	2.0955	1.0789	2.3719	3.0649	2.4143		3.2700
H7	2.7162	2.3122	1.3338	2.4388	3.7918	3.2700

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.437	C1	C2	H6	120.583
C2	C1	H4	121.993	C2	C1	H5	119.866
C2	S3	H7	96.362	S3	C2	H6	111.980
H4	C1	H5	118.141

All results from a given calculation for CH₂CHSH (Ethenethiol)

using model chemistry: MP2=FULL/cc-pVQZ

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: MP2=FULL/cc-pVQZ

States and conformations

All results from a given calculation for CH₂CHSH (Ethenethiol)