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	hartrees
Energy at 0K	-33.727187
Energy at 298.15K
HF Energy	-33.422640
Nuclear repulsion energy	61.741645

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3734	3608	29.49
2	A	3576	3456	74.51
3	A	3165	3058	17.36
4	A	3146	3040	33.43
5	A	3043	2940	36.88
6	A	1697	1640	136.27
7	A	1527	1475	5.88
8	A	1486	1436	11.49
9	A	1460	1411	17.73
10	A	1378	1332	354.86
11	A	1352	1306	39.10
12	A	1084	1047	0.05
13	A	1039	1004	24.78
14	A	992	958	51.60
15	A	710	686	5.36
16	A	647	625	149.59
17	A	480	464	98.78
18	A	438	424	134.27
19	A	424	410	1.26
20	A	358	346	0.75
21	A	17	16	1.42

Atom	x (Å)	y (Å)	z (Å)
C1	0.300	0.060	0.000
S2	-1.419	-0.111	-0.000
C3	1.270	-1.151	-0.000
N4	0.925	1.306	0.000
H5	1.086	-1.775	-0.897
H6	2.334	-0.826	0.002
H7	1.083	-1.778	0.894
H8	1.942	1.397	-0.000
H9	0.353	2.152	-0.000

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.7275	1.5512	1.3936	2.1883	2.2175	2.1883	2.1170	2.0926
S2	1.7275		2.8828	2.7384	3.1380	3.8196	3.1362	3.6830	2.8738
C3	1.5512	2.8828		2.4806	1.1079	1.1119	1.1079	2.6349	3.4276
N4	1.3936	2.7384	2.4806		3.2127	2.5547	3.2145	1.0207	1.0212
H5	2.1883	3.1380	1.1079	3.2127		1.8071	1.7903	3.4057	4.0941
H6	2.2175	3.8196	1.1119	2.5547	1.8071		1.8070	2.2571	3.5759
H7	2.1883	3.1362	1.1079	3.2145	1.7903	1.8070		3.4086	4.0958
H8	2.1170	3.6830	2.6349	1.0207	3.4057	2.2571	3.4086		1.7585
H9	2.0926	2.8738	3.4276	1.0212	4.0941	3.5759	4.0958	1.7585

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	109.641	C1	C3	H6	111.691
C1	C3	H7	109.643	C1	N4	H8	121.766
C1	N4	H9	119.325	S2	C1	C3	123.019
S2	C1	N4	122.298	C3	C1	N4	114.683
H5	C3	H6	108.989	H5	C3	H7	107.803
H6	C3	H7	108.988	H8	N4	H9	118.909

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: MP2/CEP-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/CEP-31G

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)