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	hartrees
Energy at 0K	-437.477603
Energy at 298.15K	-437.480324
HF Energy	-437.152445
Nuclear repulsion energy	48.552718

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3183	3022	1.15
2	A	3161	3001	9.82
3	A	3070	2915	6.91
4	A	1494	1419	11.30
5	A	1417	1346	7.95
6	A	1346	1278	3.39
7	A	881	836	0.78
8	A	745	707	0.56
9	A	612	581	31.52

Atom	x (Å)	y (Å)	z (Å)
C1	1.105	0.000	-0.008
S2	-0.691	0.000	-0.002
H3	1.415	-0.000	1.038
H4	1.502	-0.894	-0.480
H5	1.502	0.895	-0.479

	C1	S2	H3	H4	H5
C1		1.7960	1.0913	1.0860	1.0860
S2	1.7960		2.3490	2.4155	2.4156
H3	1.0913	2.3490		1.7637	1.7637
H4	1.0860	2.4155	1.7637		1.7889
H5	1.0860	2.4156	1.7637	1.7889

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S2	C1	H3	106.317	S2	C1	H4	111.500
S2	C1	H5	111.502	H3	C1	H4	108.203
H3	C1	H5	108.205	H4	C1	H5	110.897

All results from a given calculation for CH₃S (thiomethoxy)

using model chemistry: MP2/cc-pVTZ

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 CH3S (thiomethoxy)

using model chemistry: MP2/cc-pVTZ

States and conformations

All results from a given calculation for CH₃S (thiomethoxy)