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	hartrees
Energy at 0K	-531.412181
Energy at 298.15K
HF Energy	-530.695833
Nuclear repulsion energy	155.679727

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3754	3572	53.02
2	A	3607	3432	75.16
3	A	3220	3064	1.12
4	A	3150	2997	6.92
5	A	3074	2925	14.22
6	A	1636	1557	180.87
7	A	1501	1429	10.62
8	A	1495	1423	16.94
9	A	1411	1342	159.85
10	A	1399	1331	145.47
11	A	1339	1274	13.98
12	A	1041	991	3.13
13	A	1024	974	28.23
14	A	1002	954	2.27
15	A	757	720	2.97
16	A	619	589	4.08
17	A	513	489	8.47
18	A	427	406	0.60
19	A	379	360	1.91
20	A	250	238	164.16
21	A	51	48	0.06

Atom	x (Å)	y (Å)	z (Å)
C1	0.270	0.057	-0.009
S2	-1.358	-0.112	0.000
C3	1.227	-1.105	-0.000
N4	0.880	1.260	0.002
H5	0.697	-2.024	-0.221
H6	2.023	-0.957	-0.730
H7	1.683	-1.190	0.987
H8	1.880	1.343	-0.016
H9	0.316	2.092	0.018

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6375	1.5054	1.3485	2.1348	2.1498	2.1314	2.0601	2.0353
S2	1.6375		2.7691	2.6255	2.8152	3.5612	3.3740	3.5505	2.7682
C3	1.5054	2.7691		2.3907	1.0830	1.0905	1.0906	2.5338	3.3244
N4	1.3485	2.6255	2.3907		3.2965	2.5998	2.7604	1.0040	1.0050
H5	2.1348	2.8152	1.0830	3.2965		1.7766	1.7679	3.5742	4.1401
H6	2.1498	3.5612	1.0905	2.5998	1.7766		1.7654	2.4121	3.5736
H7	2.1314	3.3740	1.0906	2.7604	1.7679	1.7654		2.7316	3.6851
H8	2.0601	3.5505	2.5338	1.0040	3.5742	2.4121	2.7316		1.7347
H9	2.0353	2.7682	3.3244	1.0050	4.1401	3.5736	3.6851	1.7347

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.055	C1	C3	H6	110.812
C1	C3	H7	109.339	C1	N4	H8	121.574
C1	N4	H9	118.999	S2	C1	C3	123.487
S2	C1	N4	122.816	C3	C1	N4	113.686
H5	C3	H6	109.652	H5	C3	H7	108.852
H6	C3	H7	108.082	H8	N4	H9	119.424

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: MP2/Def2TZVPP

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/Def2TZVPP

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)