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	hartrees
Energy at 0K	-531.225319
Energy at 298.15K
HF Energy	-530.621329
Nuclear repulsion energy	155.177346

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3832	3593	44.98
2	A	3693	3462	90.07
3	A	3267	3063	2.88
4	A	3189	2990	13.42
5	A	3116	2922	16.64
6	A	1705	1599	195.56
7	A	1547	1450	17.64
8	A	1546	1449	8.35
9	A	1465	1374	36.86
10	A	1444	1354	351.54
11	A	1377	1292	25.56
12	A	1071	1004	0.01
13	A	1056	990	40.37
14	A	1033	968	11.41
15	A	760	713	9.98
16	A	618	579	12.88
17	A	520	487	5.70
18	A	439	411	0.72
19	A	390	365	2.15
20	A	254	238	219.02
21	A	44	41	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.271	0.059	0.000
S2	-1.366	-0.113	-0.000
C3	1.233	-1.107	-0.000
N4	0.884	1.260	0.001
H5	0.688	-2.043	0.005
H6	1.869	-1.067	-0.886
H7	1.877	-1.061	0.880
H8	1.884	1.345	-0.003
H9	0.328	2.097	-0.002

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6464	1.5116	1.3484	2.1432	2.1462	2.1465	2.0630	2.0387
S2	1.6464		2.7831	2.6360	2.8187	3.4874	3.4917	3.5625	2.7846
C3	1.5116	2.7831		2.3927	1.0837	1.0916	1.0916	2.5370	3.3292
N4	1.3484	2.6360	2.3927		3.3093	2.6779	2.6735	1.0040	1.0044
H5	2.1432	2.8187	1.0837	3.3093		1.7733	1.7734	3.5934	4.1557
H6	2.1462	3.4874	1.0916	2.6779	1.7733		1.7669	2.5683	3.6281
H7	2.1465	3.4917	1.0916	2.6735	1.7734	1.7669		2.5631	3.6262
H8	2.0630	3.5625	2.5370	1.0040	3.5934	2.5683	2.5631		1.7282
H9	2.0387	2.7846	3.3292	1.0044	4.1557	3.6281	3.6262	1.7282

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.250	C1	C3	H6	110.013
C1	C3	H7	110.038	C1	N4	H8	121.876
C1	N4	H9	119.387	S2	C1	C3	123.534
S2	C1	N4	123.017	C3	C1	N4	113.448
H5	C3	H6	109.212	H5	C3	H7	109.228
H6	C3	H7	108.059	H8	N4	H9	118.735

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: CCD/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 CH3CSNH2 (Ethanethioamide)

using model chemistry: CCD/6-31G**

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)