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	hartrees
Energy at 0K	-492.601800
Energy at 298.15K	-492.605485
HF Energy	-492.452501
Nuclear repulsion energy	94.412442

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3762	3762	48.49
2	A'	3615	3615	67.56
3	A'	3153	3153	25.75
4	A'	1669	1669	186.43
5	A'	1490	1490	165.91
6	A'	1339	1339	119.21
7	A'	1158	1158	17.80
8	A'	893	893	11.89
9	A'	438	438	2.18
10	A"	975	975	26.38
11	A"	634	634	8.44
12	A"	331	331	226.29

Atom	x (Å)	y (Å)
C1	0.000	0.641
S2	-0.778	-0.809
N3	1.331	0.823
H4	-0.550	1.582
H5	1.939	0.018
H6	1.739	1.743

	C1	S2	N3	H4	H5	H6
C1		1.6454	1.3439	1.0901	2.0368	2.0587
S2	1.6454		2.6672	2.4020	2.8407	3.5843
N3	1.3439	2.6672		2.0285	1.0084	1.0062
H4	1.0901	2.4020	2.0285		2.9394	2.2939
H5	2.0368	2.8407	1.0084	2.9394		1.7363
H6	2.0587	3.5843	1.0062	2.2939	1.7363

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.281	C1	N3	H6	121.663
S2	C1	N3	126.017	S2	C1	H4	121.498
H5	N3	H6	119.056

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: B2PLYP=FULL/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: B2PLYP=FULL/6-31G**

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)