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	hartrees
Energy at 0K	-476.518354
Energy at 298.15K	-476.522050
HF Energy	-476.386612
Nuclear repulsion energy	93.047934

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3287	3117	8.83
2	A'	3228	3062	3.49
3	A'	3198	3033	2.76
4	A'	2732	2591	12.81
5	A'	1685	1598	31.65
6	A'	1464	1389	8.50
7	A'	1336	1267	1.12
8	A'	1109	1052	27.15
9	A'	921	874	6.85
10	A'	712	675	17.40
11	A'	385	365	3.90
12	A"	1007	955	24.12
13	A"	885	840	40.88
14	A"	609	577	11.60
15	A"	277	262	19.53

Atom	x (Å)	y (Å)
C1	1.291	1.106
C2	0.000	0.765
S3	-0.695	-0.859
H4	2.089	0.371
H5	1.580	2.150
H6	-0.775	1.526
H7	0.470	-1.532

	C1	C2	S3	H4	H5	H6	H7
C1		1.3356	2.7939	1.0850	1.0836	2.1084	2.7626
C2	1.3356		1.7668	2.1264	2.1010	1.0856	2.3449
S3	2.7939	1.7668		3.0436	3.7723	2.3862	1.3452
H4	1.0850	2.1264	3.0436		1.8511	3.0883	2.4983
H5	1.0836	2.1010	3.7723	1.8511		2.4360	3.8458
H6	2.1084	1.0856	2.3862	3.0883	2.4360		3.3014
H7	2.7626	2.3449	1.3452	2.4983	3.8458	3.3014

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	S3	127.921	C1	C2	H6	120.765
C2	C1	H4	122.577	C2	C1	H5	120.205
C2	S3	H7	96.855	S3	C2	H6	111.313
H4	C1	H5	117.218

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)