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	hartrees
Energy at 0K	-492.132081
Energy at 298.15K	-492.135850
HF Energy	-491.639931
Nuclear repulsion energy	95.469812

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3863	3863	68.23
2	A'	3722	3722	97.07
3	A'	3222	3222	16.50
4	A'	1708	1708	217.53
5	A'	1534	1534	213.68
6	A'	1357	1357	212.28
7	A'	1192	1192	36.57
8	A'	933	933	24.37
9	A'	452	452	1.79
10	A"	1029	1029	23.18
11	A"	653	653	5.71
12	A"	357	357	195.77

Atom	x (Å)	y (Å)
C1	0.000	0.630
S2	-0.770	-0.800
N3	1.319	0.814
H4	-0.550	1.561
H5	1.923	0.021
H6	1.715	1.727

	C1	S2	N3	H4	H5	H6
C1		1.6240	1.3313	1.0812	2.0173	2.0354
S2	1.6240		2.6393	2.3708	2.8151	3.5436
N3	1.3313	2.6393		2.0126	0.9974	0.9951
H4	1.0812	2.3708	2.0126		2.9138	2.2712
H5	2.0173	2.8151	0.9974	2.9138		1.7189
H6	2.0354	3.5436	0.9951	2.2712	1.7189

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.365	C1	N3	H6	121.401
S2	C1	N3	126.236	S2	C1	H4	121.100
H5	N3	H6	119.234

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: CID/Def2TZVPP

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: CID/Def2TZVPP

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)