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	hartrees
Energy at 0K	-524.800541
Energy at 298.15K
HF Energy	-524.589194
Nuclear repulsion energy	151.418213

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3842	3415	2.12
2	A	3637	3233	2.63
3	A	3554	3159	0.74
4	A	3529	3137	1.92
5	A	3360	2986	1.25
6	A	1854	1648	9.32
7	A	1724	1532	0.06
8	A	1719	1528	1.85
9	A	1596	1419	0.02
10	A	1542	1370	43.49
11	A	1386	1232	53.85
12	A	1180	1049	4.87
13	A	1138	1012	6.74
14	A	1105	982	2.53
15	A	844	750	171.97
16	A	735	654	105.21
17	A	470	417	14.17
18	A	429	381	20.10
19	A	377	335	9.41
20	A	373	332	30.71
21	A	120	107	0.30

Atom	x (Å)	y (Å)	z (Å)
C1	0.239	0.039	0.006
S2	-1.382	-0.123	0.007
C3	1.269	-1.131	-0.001
N4	0.917	1.333	-0.121
H5	1.943	-1.067	0.874
H6	0.751	-2.104	0.028
H7	1.893	-1.089	-0.911
H8	1.773	1.354	0.491
H9	0.280	2.096	0.227

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6291	1.5586	1.4663	2.2088	2.2037	2.2021	2.0774	2.0690
S2	1.6291		2.8358	2.7242	3.5629	2.9109	3.5357	3.5167	2.7813
C3	1.5586	2.8358		2.4921	1.1056	1.1030	1.1049	2.5827	3.3825
N4	1.4663	2.7242	2.4921		2.7938	3.4447	2.7283	1.0523	1.0526
H5	2.2088	3.5629	1.1056	2.7938		1.7918	1.7859	2.4575	3.6315
H6	2.2037	2.9109	1.1030	3.4447	1.7918		1.7939	3.6357	4.2311
H7	2.2021	3.5357	1.1049	2.7283	1.7859	1.7939		2.8192	3.7469
H8	2.0774	3.5167	2.5827	1.0523	2.4575	3.6357	2.8192		1.6872
H9	2.0690	2.7813	3.3825	1.0526	3.6315	4.2311	3.7469	1.6872

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.859	C1	C3	H6	110.613
C1	C3	H7	110.376	C1	N4	H8	110.055
C1	N4	H9	109.350	S2	C1	C3	125.633
S2	C1	N4	123.218	C3	C1	N4	110.903
H5	C3	H6	108.442	H5	C3	H7	107.783
H6	C3	H7	108.682	H8	N4	H9	106.560

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: MP2=FULL/STO-3G

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=FULL/STO-3G

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)