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	hartrees
Energy at 0K	-492.022610
Energy at 298.15K	-492.026268
HF Energy	-491.575615
Nuclear repulsion energy	94.709773

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'	3818	3568	58.96	81.19	0.63	0.77
2	A'	3665	3424	97.20	149.87	0.15	0.26
3	A'	3199	2989	25.80	114.20	0.35	0.52
4	A'	1689	1579	205.51	4.09	0.74	0.85
5	A'	1518	1419	181.27	0.64	0.75	0.85
6	A'	1355	1266	143.77	6.43	0.74	0.85
7	A'	1178	1101	13.68	21.61	0.31	0.48
8	A'	925	865	5.67	33.69	0.27	0.43
9	A'	446	417	1.60	4.98	0.61	0.76
10	A"	985	920	31.39	1.13	0.75	0.86
11	A"	633	591	5.41	1.10	0.75	0.86
12	A"	291	272	239.90	0.13	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.000	0.634
S2	-0.780	-0.802
N3	1.334	0.815
H4	-0.544	1.576
H5	1.938	0.010
H6	1.741	1.732

	C1	S2	N3	H4	H5	H6
C1		1.6340	1.3459	1.0876	2.0365	2.0588
S2	1.6340		2.6605	2.3897	2.8363	3.5746
N3	1.3459	2.6605		2.0262	1.0067	1.0044
H4	1.0876	2.3897	2.0262		2.9351	2.2905
H5	2.0365	2.8363	1.0067	2.9351		1.7341
H6	2.0588	3.5746	1.0044	2.2905	1.7341

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.211	C1	N3	H6	121.640
S2	C1	N3	126.188	S2	C1	H4	121.513
H5	N3	H6	119.149

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: MP2=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 CHSNH2 (thioformamide)

using model chemistry: MP2=FULL/6-31G**

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)