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	hartrees
Energy at 0K	-492.200198
Energy at 298.15K	-492.203672
HF Energy	-491.610010
Nuclear repulsion energy	94.686496

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3771	3572	48.25	87.64	0.63	0.77
2	A'	3627	3435	86.41	165.70	0.17	0.29
3	A'	3145	2979	29.14	129.34	0.37	0.54
4	A'	1707	1617	189.86	2.88	0.66	0.80
5	A'	1508	1428	211.91	1.42	0.61	0.76
6	A'	1347	1276	163.87	4.05	0.75	0.86
7	A'	1180	1118	18.86	19.69	0.36	0.53
8	A'	924	875	8.23	37.02	0.25	0.40
9	A'	445	421	1.35	4.61	0.72	0.83
10	A"	958	907	47.63	1.04	0.75	0.86
11	A"	622	589	1.01	1.14	0.75	0.86
12	A"	166	157	254.49	0.20	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.000	0.635
S2	-0.779	-0.803
N3	1.333	0.816
H4	-0.553	1.577
H5	1.940	0.012
H6	1.740	1.734

	C1	S2	N3	H4	H5	H6
C1		1.6345	1.3449	1.0926	2.0376	2.0587
S2	1.6345		2.6600	2.3904	2.8384	3.5750
N3	1.3449	2.6600		2.0333	1.0073	1.0051
H4	1.0926	2.3904	2.0333		2.9434	2.2984
H5	2.0376	2.8384	1.0073	2.9434		1.7336
H6	2.0587	3.5750	1.0051	2.2984	1.7336

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.370	C1	N3	H6	121.665
S2	C1	N3	126.183	S2	C1	H4	121.163
H5	N3	H6	118.965

All results from a given calculation for CHSNH₂ (thioformamide)

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 CHSNH2 (thioformamide)

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

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)