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	hartrees
Energy at 0K	-492.208502
Energy at 298.15K	-492.212165
HF Energy	-491.641100
Nuclear repulsion energy	94.753136

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3766	3544	55.39
2	A'	3625	3412	87.02
3	A'	3143	2958	18.03
4	A'	1662	1565	194.20
5	A'	1491	1403	194.89
6	A'	1327	1249	174.17
7	A'	1156	1088	25.49
8	A'	901	848	16.42
9	A'	436	411	1.86
10	A"	988	930	24.64
11	A"	630	593	3.34
12	A"	300	282	185.58

Atom	x (Å)	y (Å)
C1	0.000	0.638
S2	-0.775	-0.806
N3	1.327	0.820
H4	-0.552	1.575
H5	1.933	0.019
H6	1.728	1.738

	C1	S2	N3	H4	H5	H6
C1		1.6391	1.3398	1.0873	2.0295	2.0483
S2	1.6391		2.6579	2.3918	2.8307	3.5690
N3	1.3398	2.6579		2.0251	1.0040	1.0017
H4	1.0873	2.3918	2.0251		2.9315	2.2854
H5	2.0295	2.8307	1.0040	2.9315		1.7312
H6	2.0483	3.5690	1.0017	2.2854	1.7312

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.282	C1	N3	H6	121.370
S2	C1	N3	126.016	S2	C1	H4	121.298
H5	N3	H6	119.347

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: CCSD/cc-pVTZ

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/cc-pVTZ

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)