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	hartrees
Energy at 0K	-531.269327
Energy at 298.15K
HF Energy	-530.658706
Nuclear repulsion energy	154.605509

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3751	3591	29.52
2	A	3623	3468	66.01
3	A	3180	3045	3.05
4	A	3105	2973	14.73
5	A	3040	2911	17.66
6	A	1715	1642	156.81
7	A	1516	1451	12.45
8	A	1516	1451	17.58
9	A	1443	1382	50.23
10	A	1417	1356	299.11
11	A	1365	1307	27.05
12	A	1053	1008	5.15
13	A	1039	995	24.58
14	A	1027	983	15.34
15	A	742	710	8.21
16	A	606	580	14.49
17	A	504	482	14.31
18	A	436	417	0.71
19	A	385	368	0.88
20	A	208	200	255.42
21	A	51	49	0.08

Atom	x (Å)	y (Å)	z (Å)
C1	0.275	0.060	-0.007
S2	-1.372	-0.116	0.002
C3	1.242	-1.106	0.000
N4	0.883	1.267	-0.024
H5	0.710	-2.042	-0.164
H6	2.003	-0.981	-0.780
H7	1.753	-1.156	0.971
H8	1.879	1.354	0.086
H9	0.319	2.097	0.061

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6559	1.5150	1.3513	2.1524	2.1605	2.1491	2.0634	2.0384
S2	1.6559		2.7950	2.6445	2.8408	3.5706	3.4325	3.5687	2.7855
C3	1.5150	2.7950		2.4000	1.0895	1.0973	1.0979	2.5428	3.3336
N4	1.3513	2.6445	2.4000		3.3164	2.6225	2.7598	1.0065	1.0065
H5	2.1524	2.8408	1.0895	3.3164		1.7833	1.7782	3.6008	4.1634
H6	2.1605	3.5706	1.0973	2.6225	1.7833		1.7776	2.4932	3.6071
H7	2.1491	3.4325	1.0979	2.7598	1.7782	1.7776		2.6645	3.6692
H8	2.0634	3.5687	2.5428	1.0065	3.6008	2.4932	2.6645		1.7277
H9	2.0384	2.7855	3.3336	1.0065	4.1634	3.6071	3.6692	1.7277

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.400	C1	C3	H6	110.575
C1	C3	H7	109.640	C1	N4	H8	121.427
C1	N4	H9	118.936	S2	C1	C3	123.582
S2	C1	N4	122.821	C3	C1	N4	113.597
H5	C3	H6	109.268	H5	C3	H7	108.765
H6	C3	H7	108.141	H8	N4	H9	118.240

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: QCISD/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 CH3CSNH2 (Ethanethioamide)

using model chemistry: QCISD/6-311G*

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)