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	hartrees
Energy at 0K	-486.156095
Energy at 298.15K
HF Energy	-486.002647
Nuclear repulsion energy	93.114225

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'	4020	3573	5.37	48.42	0.71	0.83
2	A'	3790	3369	85.43	141.44	0.16	0.28
3	A'	3371	2997	13.55	47.56	0.37	0.54
4	A'	1796	1597	72.16	19.12	0.56	0.72
5	A'	1622	1441	89.31	1.41	0.68	0.81
6	A'	1392	1237	93.73	17.05	0.64	0.78
7	A'	1212	1077	9.11	5.39	0.14	0.24
8	A'	967	860	6.98	14.29	0.27	0.42
9	A'	434	386	1.05	3.62	0.54	0.70
10	A"	945	840	7.91	0.02	0.75	0.86
11	A"	565	502	0.73	2.84	0.75	0.86
12	A"	569i	506i	250.79	0.08	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.000	0.628
S2	-0.828	-0.770
N3	1.404	0.758
H4	-0.460	1.642
H5	2.014	-0.078
H6	1.871	1.681

	C1	S2	N3	H4	H5	H6
C1		1.6247	1.4096	1.1134	2.1343	2.1465
S2	1.6247		2.7047	2.4396	2.9254	3.6453
N3	1.4096	2.7047		2.0624	1.0352	1.0340
H4	1.1134	2.4396	2.0624		3.0130	2.3309
H5	2.1343	2.9254	1.0352	3.0130		1.7643
H6	2.1465	3.6453	1.0340	2.3309	1.7643

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	120.848	C1	N3	H6	122.152
S2	C1	N3	125.949	S2	C1	H4	124.953
H5	N3	H6	117.000

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: MP2=FULL/STO-3G

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/STO-3G

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)