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	hartrees
Energy at 0K	-492.157238
Energy at 298.15K
HF Energy	-491.623081
Nuclear repulsion energy	94.789030

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3798	3546	53.75
2	A'	3662	3419	93.98
3	A'	3183	2972	19.28
4	A'	1683	1571	210.02
5	A'	1507	1408	197.82
6	A'	1331	1243	241.98
7	A'	1173	1096	25.30
8	A'	916	855	14.71
9	A'	444	415	1.17
10	A"	947	885	41.74
11	A"	594	554	0.04
12	A"	147i	137i	210.62

Atom	x (Å)	y (Å)
C1	0.000	0.639
S2	-0.777	-0.803
N3	1.329	0.814
H4	-0.547	1.577
H5	1.932	0.012
H6	1.736	1.730

	C1	S2	N3	H4	H5	H6
C1		1.6377	1.3409	1.0861	2.0315	2.0504
S2	1.6377		2.6556	2.3910	2.8290	3.5679
N3	1.3409	2.6556		2.0255	1.0039	1.0019
H4	1.0861	2.3910	2.0255		2.9321	2.2880
H5	2.0315	2.8290	1.0039	2.9321		1.7296
H6	2.0504	3.5679	1.0019	2.2880	1.7296

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.386	C1	N3	H6	121.458
S2	C1	N3	125.847	S2	C1	H4	121.433
H5	N3	H6	119.155

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: MP3=FULL/TZVP

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: MP3=FULL/TZVP

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)