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	hartrees
Energy at 0K	-492.058244
Energy at 298.15K	-492.061726
HF Energy	-491.595341
Nuclear repulsion energy	93.923864

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3753	3601	51.28
2	A'	3604	3458	80.38
3	A'	3131	3004	28.72
4	A'	1643	1577	208.80
5	A'	1485	1425	161.51
6	A'	1326	1272	132.13
7	A'	1145	1098	17.82
8	A'	893	856	12.30
9	A'	434	417	1.85
10	A"	972	933	22.76
11	A"	625	600	2.95
12	A"	179	172	195.84

Atom	x (Å)	y (Å)
C1	0.000	0.644
S2	-0.782	-0.813
N3	1.338	0.825
H4	-0.552	1.601
H5	1.947	0.013
H6	1.747	1.751

	C1	S2	N3	H4	H5	H6
C1		1.6531	1.3503	1.1043	2.0468	2.0683
S2	1.6531		2.6787	2.4242	2.8510	3.6011
N3	1.3503	2.6787		2.0427	1.0150	1.0125
H4	1.1043	2.4242	2.0427		2.9604	2.3034
H5	2.0468	2.8510	1.0150	2.9604		1.7498
H6	2.0683	3.6011	1.0125	2.3034	1.7498

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.168	C1	N3	H6	121.517
S2	C1	N3	125.927	S2	C1	H4	121.810
H5	N3	H6	119.315

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: QCISD/cc-pVDZ

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/cc-pVDZ

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)