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	hartrees
Energy at 0K	-476.036923
Energy at 298.15K	-476.040631
HF Energy	-475.561785
Nuclear repulsion energy	93.435981

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3320	3136	2.09
2	A'	3248	3067	2.60
3	A'	3217	3039	0.91
4	A'	2780	2625	0.08
5	A'	1657	1565	26.52
6	A'	1444	1364	7.65
7	A'	1315	1242	2.18
8	A'	1093	1032	21.86
9	A'	903	853	5.60
10	A'	725	685	16.36
11	A'	381	360	4.29
12	A"	1013	957	18.22
13	A"	895	845	34.20
14	A"	612	578	10.67
15	A"	274	258	15.89

Atom	x (Å)	y (Å)
C1	1.296	1.088
C2	0.000	0.763
S3	-0.696	-0.849
H4	2.079	0.341
H5	1.593	2.127
H6	-0.767	1.530
H7	0.463	-1.517

	C1	C2	S3	H4	H5	H6	H7
C1		1.3358	2.7787	1.0825	1.0814	2.1094	2.7350
C2	1.3358		1.7567	2.1216	2.0974	1.0842	2.3271
S3	2.7787	1.7567		3.0197	3.7555	2.3802	1.3377
H4	1.0825	2.1216	3.0197		1.8517	3.0843	2.4626
H5	1.0814	2.0974	3.7555	1.8517		2.4345	3.8161
H6	2.1094	1.0842	2.3802	3.0843	2.4345		3.2858
H7	2.7350	2.3271	1.3377	2.4626	3.8161	3.2858

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.408	C1	C2	H6	120.960
C2	C1	H4	122.295	C2	C1	H5	120.019
C2	S3	H7	96.600	S3	C2	H6	111.633
H4	C1	H5	117.686

All results from a given calculation for CH₂CHSH (Ethenethiol)

using model chemistry: MP2/6-31G(2df,p)

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: MP2/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₂CHSH (Ethenethiol)