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	hartrees
Energy at 0K	-492.062198
Energy at 298.15K	-492.065685
HF Energy	-491.610119
Nuclear repulsion energy	94.675190

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3774	3605	41.34
2	A'	3642	3478	88.54
3	A'	3127	2987	24.76
4	A'	1720	1643	204.70
5	A'	1514	1446	247.99
6	A'	1340	1280	232.69
7	A'	1186	1132	34.32
8	A'	923	882	20.96
9	A'	446	426	1.27
10	A"	969	925	40.64
11	A"	619	591	2.02
12	A"	173	165	260.56

Atom	x (Å)	y (Å)
C1	0.000	0.634
S2	-0.776	-0.806
N3	1.329	0.822
H4	-0.560	1.574
H5	1.944	0.025
H6	1.732	1.742

	C1	S2	N3	H4	H5	H6
C1		1.6358	1.3426	1.0942	2.0370	2.0562
S2	1.6358		2.6616	2.3897	2.8443	3.5756
N3	1.3426	2.6616		2.0336	1.0064	1.0045
H4	1.0942	2.3897	2.0336		2.9443	2.2982
H5	2.0370	2.8443	1.0064	2.9443		1.7303
H6	2.0562	3.5756	1.0045	2.2982	1.7303

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.579	C1	N3	H6	121.678
S2	C1	N3	126.387	S2	C1	H4	120.879
H5	N3	H6	118.743

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: CCD/6-311G*

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: CCD/6-311G*

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)