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	hartrees
Energy at 0K	-476.167745
Energy at 298.15K	-476.171396
HF Energy	-475.588423
Nuclear repulsion energy	93.328037

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3293	3124	6.40
2	A'	3223	3057	3.61
3	A'	3191	3027	2.00
4	A'	2798	2654	2.73
5	A'	1653	1568	32.47
6	A'	1438	1364	8.39
7	A'	1315	1248	1.01
8	A'	1094	1037	29.75
9	A'	918	871	6.14
10	A'	728	690	16.86
11	A'	383	364	4.24
12	A"	992	941	30.40
13	A"	842	799	40.54
14	A"	590	560	14.87
15	A"	243	230	17.03

Atom	x (Å)	y (Å)
C1	1.298	1.092
C2	0.000	0.761
S3	-0.698	-0.851
H4	2.084	0.344
H5	1.590	2.135
H6	-0.764	1.533
H7	0.466	-1.507

	C1	C2	S3	H4	H5	H6	H7
C1		1.3392	2.7852	1.0851	1.0835	2.1086	2.7290
C2	1.3392		1.7570	2.1255	2.1012	1.0861	2.3159
S3	2.7852	1.7570		3.0278	3.7619	2.3854	1.3357
H4	1.0851	2.1255	3.0278		1.8581	3.0865	2.4590
H5	1.0835	2.1012	3.7619	1.8581		2.4296	3.8120
H6	2.1086	1.0861	2.3854	3.0865	2.4296		3.2798
H7	2.7290	2.3159	1.3357	2.4590	3.8120	3.2798

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.683	C1	C2	H6	120.418
C2	C1	H4	122.159	C2	C1	H5	119.921
C2	S3	H7	96.020	S3	C2	H6	111.898
H4	C1	H5	117.920

All results from a given calculation for CH₂CHSH (Ethenethiol)

using model chemistry: MP2=FULL/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: MP2=FULL/6-311G**

States and conformations

All results from a given calculation for CH₂CHSH (Ethenethiol)