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	hartrees
Energy at 0K	-492.042313
Energy at 298.15K	-492.045757
HF Energy	-491.609944
Nuclear repulsion energy	94.627679

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3769	3582	47.96	87.76	0.63	0.77
2	A'	3625	3445	86.15	166.07	0.17	0.29
3	A'	3142	2986	29.30	129.33	0.37	0.54
4	A'	1706	1621	187.47	2.88	0.66	0.80
5	A'	1506	1431	210.60	1.39	0.62	0.76
6	A'	1345	1278	166.84	4.07	0.75	0.86
7	A'	1179	1121	19.02	19.65	0.36	0.53
8	A'	923	877	8.33	37.24	0.25	0.40
9	A'	444	422	1.33	4.62	0.71	0.83
10	A"	956	909	47.69	1.04	0.75	0.86
11	A"	621	590	0.86	1.14	0.75	0.86
12	A"	149	142	254.26	0.20	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.000	0.635
S2	-0.779	-0.803
N3	1.334	0.816
H4	-0.552	1.578
H5	1.941	0.012
H6	1.742	1.734

	C1	S2	N3	H4	H5	H6
C1		1.6357	1.3459	1.0930	2.0388	2.0598
S2	1.6357		2.6616	2.3921	2.8396	3.5769
N3	1.3459	2.6616		2.0346	1.0075	1.0054
H4	1.0930	2.3921	2.0346		2.9449	2.2997
H5	2.0388	2.8396	1.0075	2.9449		1.7342
H6	2.0598	3.5769	1.0054	2.2997	1.7342

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H5	119.370	C1	N3	H6	121.656
S2	C1	N3	126.147	S2	C1	H4	121.196
H5	N3	H6	118.974

All results from a given calculation for CHSNH₂ (thioformamide)

using model chemistry: MP2/6-311G*

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: MP2/6-311G*

States and conformations

All results from a given calculation for CHSNH₂ (thioformamide)