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	hartrees
Energy at 0K	-531.299865
Energy at 298.15K
HF Energy	-530.669682
Nuclear repulsion energy	155.070023

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3772	3603	38.49
2	A	3643	3479	81.93
3	A	3203	3059	2.89
4	A	3129	2989	13.80
5	A	3062	2924	17.16
6	A	1678	1603	177.22
7	A	1509	1442	17.69
8	A	1508	1440	18.63
9	A	1435	1370	45.84
10	A	1419	1355	367.49
11	A	1363	1302	16.40
12	A	1053	1006	11.10
13	A	1037	990	42.18
14	A	1028	982	4.27
15	A	759	725	7.86
16	A	597	570	12.36
17	A	504	481	12.14
18	A	438	419	0.62
19	A	386	369	1.03
20	A	229	218	234.44
21	A	51	49	0.77

Atom	x (Å)	y (Å)	z (Å)
C1	0.268	0.060	-0.008
S2	-1.365	-0.114	0.002
C3	1.235	-1.107	0.001
N4	0.883	1.263	-0.028
H5	0.705	-2.040	-0.185
H6	2.008	-0.967	-0.764
H7	1.727	-1.165	0.980
H8	1.879	1.339	0.095
H9	0.325	2.095	0.073

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6433	1.5156	1.3511	2.1524	2.1575	2.1456	2.0590	2.0366
S2	1.6433		2.7837	2.6371	2.8340	3.5634	3.4090	3.5562	2.7821
C3	1.5156	2.7837		2.3964	1.0888	1.0965	1.0970	2.5313	3.3291
N4	1.3511	2.6371	2.3964		3.3117	2.6045	2.7613	1.0061	1.0063
H5	2.1524	2.8340	1.0888	3.3117		1.7844	1.7787	3.5880	4.1598
H6	2.1575	3.5634	1.0965	2.6045	1.7844		1.7774	2.4647	3.5928
H7	2.1456	3.4090	1.0970	2.7613	1.7787	1.7774		2.6606	3.6626
H8	2.0590	3.5562	2.5313	1.0061	3.5880	2.4647	2.6606		1.7279
H9	2.0366	2.7821	3.3291	1.0063	4.1598	3.5928	3.6626	1.7279

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.400	C1	C3	H6	110.346
C1	C3	H7	109.379	C1	N4	H8	121.043
C1	N4	H9	118.794	S2	C1	C3	123.533
S2	C1	N4	123.157	C3	C1	N4	113.310
H5	C3	H6	109.484	H5	C3	H7	108.933
H6	C3	H7	108.255	H8	N4	H9	118.327

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: CCD/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: CCD/6-311G**

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)