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	hartrees
Energy at 0K	-475.985926
Energy at 298.15K	-475.989741
HF Energy	-475.576161
Nuclear repulsion energy	92.242061

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3210	3057	5.50
2	A'	3118	2970	25.59
3	A'	3070	2924	6.40
4	A'	1479	1408	4.89
5	A'	1396	1330	46.17
6	A'	1377	1311	10.27
7	A'	1196	1140	12.69
8	A'	1085	1034	1.15
9	A'	847	807	3.83
10	A'	397	378	1.39
11	A"	3154	3004	6.67
12	A"	1471	1401	9.04
13	A"	1043	993	3.71
14	A"	765	728	13.59
15	A"	174	165	0.28

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.629	0.000
C2	-1.500	0.708	0.000
S3	0.883	-0.742	0.000
H4	0.516	1.606	0.000
H5	-1.954	-0.294	0.000
H6	-1.844	1.271	0.887
H7	-1.844	1.271	-0.887

	C1	C2	S3	H4	H5	H6	H7
C1		1.5023	1.6304	1.1053	2.1608	2.1446	2.1446
C2	1.5023		2.7894	2.2074	1.0998	1.1052	1.1052
S3	1.6304	2.7894		2.3765	2.8718	3.5034	3.5034
H4	1.1053	2.2074	2.3765		3.1163	2.5434	2.5434
H5	2.1608	1.0998	2.8718	3.1163		1.8021	1.8021
H6	2.1446	1.1052	3.5034	2.5434	1.8021		1.7732
H7	2.1446	1.1052	3.5034	2.5434	1.8021	1.7732

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	111.342	C1	C2	H6	109.724
C1	C2	H7	109.724	C2	C1	S3	125.804
C2	C1	H4	114.818	S3	C1	H4	119.378
H5	C2	H6	109.628	H5	C2	H7	109.628
H6	C2	H7	106.683

All results from a given calculation for CH₃CHS (Thioacetaldehyde)

using model chemistry: MP2/cc-pVDZ

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 CH3CHS (Thioacetaldehyde)

using model chemistry: MP2/cc-pVDZ

States and conformations

All results from a given calculation for CH₃CHS (Thioacetaldehyde)