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	hartrees
Energy at 0K	-492.005368
Energy at 298.15K	-492.008969
HF Energy	-491.565447
Nuclear repulsion energy	94.239942

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3730	3552	49.35
2	A'	3598	3427	90.63
3	A'	3149	2998	22.85
4	A'	1685	1605	200.84
5	A'	1507	1435	182.81
6	A'	1346	1282	165.93
7	A'	1172	1116	23.07
8	A'	897	854	15.03
9	A'	442	421	1.84
10	A"	976	930	27.60
11	A"	625	596	7.41
12	A"	267	254	262.65

Atom	x (Å)	y (Å)
C1	0.000	0.641
S2	-0.780	-0.810
N3	1.334	0.824
H4	-0.556	1.583
H5	1.947	0.017
H6	1.745	1.747

	C1	S2	N3	H4	H5	H6
C1		1.6467	1.3463	1.0944	2.0444	2.0665
S2	1.6467		2.6712	2.4036	2.8495	3.5934
N3	1.3463	2.6712		2.0366	1.0131	1.0109
H4	1.0944	2.4036	2.0366		2.9525	2.3069
H5	2.0444	2.8495	1.0131	2.9525		1.7414
H6	2.0665	3.5934	1.0109	2.3069	1.7414

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.440	C1	N3	H6	121.838
S2	C1	N3	126.076	S2	C1	H4	121.220
H5	N3	H6	118.722

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: QCISD/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: QCISD/6-31G*

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)