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	hartrees
Energy at 0K	-143.273527
Energy at 298.15K
HF Energy	-142.945207
Nuclear repulsion energy	99.748190

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3725	3588	35.22
2	A	3572	3441	79.66
3	A	3163	3047	9.89
4	A	3118	3003	26.23
5	A	3024	2913	26.10
6	A	1709	1646	129.65
7	A	1535	1478	5.54
8	A	1513	1457	11.29
9	A	1460	1407	17.42
10	A	1389	1338	314.95
11	A	1349	1299	64.28
12	A	1085	1045	0.75
13	A	1043	1004	20.28
14	A	1004	967	42.96
15	A	711	685	4.27
16	A	657	632	154.53
17	A	491	473	82.20
18	A	479	461	115.24
19	A	430	414	1.32
20	A	368	355	1.43
21	A	58	56	0.82

Atom	x (Å)	y (Å)	z (Å)
C1	0.292	0.058	-0.013
S2	-1.410	-0.104	0.000
C3	1.253	-1.142	0.001
N4	0.930	1.287	0.001
H5	0.826	-1.970	-0.584
H6	2.242	-0.878	-0.418
H7	1.394	-1.494	1.039
H8	1.943	1.363	-0.013
H9	0.377	2.140	0.028

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.7097	1.5376	1.3848	2.1730	2.2003	2.1747	2.1046	2.0843
S2	1.7097		2.8589	2.7218	2.9706	3.7564	3.2978	3.6598	2.8682
C3	1.5376	2.8589		2.4504	1.0999	1.1058	1.1049	2.5982	3.3972
N4	1.3848	2.7218	2.4504		3.3102	2.5655	3.0046	1.0163	1.0169
H5	2.1730	2.9706	1.0999	3.3102		1.7955	1.7838	3.5607	4.1791
H6	2.2003	3.7564	1.1058	2.5655	1.7955		1.7954	2.2963	3.5753
H7	2.1747	3.2978	1.1049	3.0046	1.7838	1.7954		3.0938	3.9068
H8	2.1046	3.6598	2.5982	1.0163	3.5607	2.2963	3.0938		1.7489
H9	2.0843	2.8682	3.3972	1.0169	4.1791	3.5753	3.9068	1.7489

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	109.837	C1	C3	H6	111.637
C1	C3	H7	109.681	C1	N4	H8	121.698
C1	N4	H9	119.626	S2	C1	C3	123.287
S2	C1	N4	122.831	C3	C1	N4	113.858
H5	C3	H6	108.983	H5	C3	H7	108.011
H6	C3	H7	108.611	H8	N4	H9	118.675

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: MP2/LANL2DZ

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 CH3CSNH2 (Ethanethioamide)

using model chemistry: MP2/LANL2DZ

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)