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	hartrees
Energy at 0K	-492.100263
Energy at 298.15K
HF Energy	-491.622809
Nuclear repulsion energy	94.492240

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3761	3590	49.40
2	A'	3623	3458	86.73
3	A'	3155	3011	21.10
4	A'	1671	1595	187.04
5	A'	1492	1424	183.71
6	A'	1320	1260	225.69
7	A'	1162	1109	24.69
8	A'	896	855	14.87
9	A'	439	419	1.14
10	A"	937	895	38.48
11	A"	587	560	0.02
12	A"	167i	160i	210.90

Atom	x (Å)	y (Å)
C1	0.000	0.641
S2	-0.778	-0.807
N3	1.332	0.818
H4	-0.549	1.582
H5	1.937	0.014
H6	1.740	1.736

	C1	S2	N3	H4	H5	H6
C1		1.6441	1.3440	1.0888	2.0365	2.0555
S2	1.6441		2.6637	2.3996	2.8370	3.5788
N3	1.3440	2.6637		2.0302	1.0065	1.0044
H4	1.0888	2.3996	2.0302		2.9393	2.2936
H5	2.0365	2.8370	1.0065	2.9393		1.7338
H6	2.0555	3.5788	1.0044	2.2936	1.7338

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.396	C1	N3	H6	121.478
S2	C1	N3	125.808	S2	C1	H4	121.483
H5	N3	H6	119.126

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: CCSD/TZVP

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/TZVP

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)