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	hartrees
Energy at 0K	-531.149719
Energy at 298.15K
HF Energy	-530.607852
Nuclear repulsion energy	154.978452

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3742	3529	50.92
2	A	3605	3399	91.16
3	A	3251	3066	1.15
4	A	3178	2997	9.06
5	A	3102	2925	12.32
6	A	1682	1586	189.63
7	A	1547	1459	12.57
8	A	1546	1458	10.97
9	A	1459	1376	82.39
10	A	1446	1364	234.35
11	A	1368	1290	24.06
12	A	1070	1009	0.02
13	A	1056	996	26.80
14	A	1024	966	2.51
15	A	761	718	4.34
16	A	617	582	11.50
17	A	516	486	10.12
18	A	437	412	0.73
19	A	391	368	1.64
20	A	210	198	232.73
21	A	34	32	0.10

Atom	x (Å)	y (Å)	z (Å)
C1	0.271	0.056	-0.000
S2	-1.366	-0.113	-0.000
C3	1.234	-1.107	0.000
N4	0.883	1.262	0.001
H5	0.684	-2.046	-0.003
H6	1.878	-1.066	-0.885
H7	1.874	-1.070	0.888
H8	1.890	1.353	-0.003
H9	0.321	2.104	-0.001

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6464	1.5099	1.3523	2.1424	2.1509	2.1506	2.0744	2.0477
S2	1.6464		2.7837	2.6368	2.8178	3.4958	3.4931	3.5717	2.7857
C3	1.5099	2.7837		2.3950	1.0879	1.0955	1.0955	2.5463	3.3378
N4	1.3523	2.6368	2.3950		3.3141	2.6827	2.6844	1.0112	1.0120
H5	2.1424	2.8178	1.0879	3.3141		1.7785	1.7785	3.6068	4.1652
H6	2.1509	3.4958	1.0955	2.6827	1.7785		1.7732	2.5752	3.6408
H7	2.1506	3.4931	1.0955	2.6844	1.7785	1.7732		2.5818	3.6430
H8	2.0744	3.5717	2.5463	1.0112	3.6068	2.5752	2.5818		1.7397
H9	2.0477	2.7857	3.3378	1.0120	4.1652	3.6408	3.6430	1.7397

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.048	C1	C3	H6	110.272
C1	C3	H7	110.250	C1	N4	H8	122.074
C1	N4	H9	119.323	S2	C1	C3	123.694
S2	C1	N4	122.820	C3	C1	N4	113.486
H5	C3	H6	109.083	H5	C3	H7	109.081
H6	C3	H7	108.064	H8	N4	H9	118.601

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: MP2/6-31G*

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: MP2/6-31G*

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)