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	hartrees
Energy at 0K	-491.996270
Energy at 298.15K	-491.999920
HF Energy	-491.565840
Nuclear repulsion energy	94.622139

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3771	3540	56.81
2	A'	3642	3419	103.09
3	A'	3186	2990	19.21
4	A'	1700	1595	238.87
5	A'	1528	1435	207.54
6	A'	1358	1275	191.92
7	A'	1188	1115	25.94
8	A'	927	870	16.02
9	A'	448	421	1.88
10	A"	988	928	30.91
11	A"	632	593	7.71
12	A"	287	270	265.38

Atom	x (Å)	y (Å)
C1	0.000	0.636
S2	-0.778	-0.804
N3	1.331	0.818
H4	-0.554	1.577
H5	1.942	0.013
H6	1.742	1.739

	C1	S2	N3	H4	H5	H6
C1		1.6371	1.3433	1.0917	2.0395	2.0612
S2	1.6371		2.6605	2.3915	2.8401	3.5797
N3	1.3433	2.6605		2.0322	1.0104	1.0082
H4	1.0917	2.3915	2.0322		2.9455	2.3016
H5	2.0395	2.8401	1.0104	2.9455		1.7370
H6	2.0612	3.5797	1.0082	2.3016	1.7370

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.443	C1	N3	H6	121.810
S2	C1	N3	126.139	S2	C1	H4	121.123
H5	N3	H6	118.748

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)