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	hartrees
Energy at 0K	-492.092905
Energy at 298.15K	-492.096193
HF Energy	-491.618051
Nuclear repulsion energy	94.484042

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3766	3766	47.44
2	A'	3630	3630	93.84
3	A'	3139	3139	24.81
4	A'	1669	1669	197.19
5	A'	1497	1497	207.08
6	A'	1330	1330	203.81
7	A'	1164	1164	23.99
8	A'	905	905	16.19
9	A'	439	439	1.16
10	A"	965	965	34.78
11	A"	605	605	0.95
12	A"	66	66	219.48

Atom	x (Å)	y (Å)
C1	0.000	0.637
S2	-0.778	-0.807
N3	1.333	0.822
H4	-0.554	1.579
H5	1.944	0.021
H6	1.734	1.744

	C1	S2	N3	H4	H5	H6
C1		1.6402	1.3458	1.0929	2.0396	2.0575
S2	1.6402		2.6668	2.3967	2.8460	3.5807
N3	1.3458	2.6668		2.0329	1.0077	1.0057
H4	1.0929	2.3967	2.0329		2.9441	2.2935
H5	2.0396	2.8460	1.0077	2.9441		1.7361
H6	2.0575	3.5807	1.0057	2.2935	1.7361

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.442	C1	N3	H6	121.407
S2	C1	N3	126.246	S2	C1	H4	121.232
H5	N3	H6	119.151

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: CCSD/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: CCSD/6-311G**

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)