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	hartrees
Energy at 0K	-531.279489
Energy at 298.15K
HF Energy	-530.676723
Nuclear repulsion energy	155.118264

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3741	3546	42.59
2	A	3601	3413	67.85
3	A	3225	3057	2.18
4	A	3161	2996	10.98
5	A	3083	2923	15.61
6	A	1657	1571	153.90
7	A	1505	1426	13.18
8	A	1499	1421	12.49
9	A	1427	1352	21.79
10	A	1407	1333	296.54
11	A	1349	1279	17.80
12	A	1055	1000	6.38
13	A	1030	976	31.10
14	A	1019	965	2.86
15	A	758	718	1.91
16	A	602	570	21.87
17	A	484	458	15.04
18	A	435	412	4.47
19	A	386	366	9.28
20	A	350	332	213.41
21	A	79	75	2.65

Atom	x (Å)	y (Å)	z (Å)
C1	0.273	0.057	-0.010
S2	-1.365	-0.111	0.003
C3	1.230	-1.107	0.001
N4	0.887	1.265	-0.037
H5	0.731	-2.003	-0.352
H6	2.100	-0.906	-0.628
H7	1.577	-1.285	1.021
H8	1.878	1.339	0.128
H9	0.321	2.087	0.100

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6469	1.5068	1.3548	2.1380	2.1548	2.1360	2.0582	2.0336
S2	1.6469		2.7793	2.6392	2.8454	3.6097	3.3266	3.5543	2.7722
C3	1.5068	2.7793		2.3969	1.0849	1.0915	1.0921	2.5337	3.3226
N4	1.3548	2.6392	2.3969		3.2868	2.5555	2.8456	1.0072	1.0077
H5	2.1380	2.8454	1.0849	3.2868		1.7757	1.7656	3.5661	4.1357
H6	2.1548	3.6097	1.0915	2.5555	1.7757		1.7708	2.3792	3.5569
H7	2.1360	3.3266	1.0921	2.8456	1.7656	1.7708		2.7882	3.7143
H8	2.0582	3.5543	2.5337	1.0072	3.5661	2.3792	2.7882		1.7273
H9	2.0336	2.7722	3.3226	1.0077	4.1357	3.5569	3.7143	1.7273

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.100	C1	C3	H6	111.046
C1	C3	H7	109.513	C1	N4	H8	120.520
C1	N4	H9	118.062	S2	C1	C3	123.533
S2	C1	N4	122.802	C3	C1	N4	113.664
H5	C3	H6	109.351	H5	C3	H7	108.398
H6	C3	H7	108.374	H8	N4	H9	118.011

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: MP2/TZVP

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/TZVP

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)