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	hartrees
Energy at 0K	-531.232336
Energy at 298.15K
HF Energy	-530.607383
Nuclear repulsion energy	154.377937

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3708	3566
2	A	3575	3438
3	A	3200	3077
4	A	3125	3005
5	A	3056	2939
6	A	1674	1609
7	A	1530	1472
8	A	1530	1471
9	A	1445	1389
10	A	1427	1372
11	A	1353	1301
12	A	1059	1019
13	A	1043	1003
14	A	1013	974
15	A	742	713
16	A	612	588
17	A	509	490
18	A	432	415
19	A	384	369
20	A	168	162
21	A	19	18

Atom	x (Å)	y (Å)	z (Å)
C1	0.274	0.057	-0.001
S2	-1.373	-0.113	-0.000
C3	1.240	-1.110	0.000
N4	0.887	1.265	0.002
H5	0.689	-2.052	-0.011
H6	1.892	-1.065	-0.883
H7	1.876	-1.076	0.896
H8	1.896	1.358	-0.007
H9	0.324	2.108	-0.002

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6565	1.5139	1.3554	2.1487	2.1575	2.1567	2.0796	2.0520
S2	1.6565		2.7967	2.6481	2.8304	3.5144	3.5054	3.5855	2.7957
C3	1.5139	2.7967		2.4009	1.0914	1.0991	1.0991	2.5535	3.3453
N4	1.3554	2.6481	2.4009		3.3230	2.6877	2.6942	1.0131	1.0136
H5	2.1487	2.8304	1.0914	3.3230		1.7840	1.7839	3.6172	4.1757
H6	2.1575	3.5144	1.0991	2.6877	1.7840		1.7791	2.5765	3.6473
H7	2.1567	3.5054	1.0991	2.6942	1.7839	1.7791		2.5964	3.6542
H8	2.0796	3.5855	2.5535	1.0131	3.6172	2.5765	2.5964		1.7418
H9	2.0520	2.7957	3.3453	1.0136	4.1757	3.6473	3.6542	1.7418

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.067	C1	C3	H6	110.306
C1	C3	H7	110.244	C1	N4	H8	122.144
C1	N4	H9	119.344	S2	C1	C3	123.737
S2	C1	N4	122.779	C3	C1	N4	113.484
H5	C3	H6	109.062	H5	C3	H7	109.057
H6	C3	H7	108.060	H8	N4	H9	118.505

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: MP4=FULL/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: MP4=FULL/6-31G*

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)