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	hartrees
Energy at 0K	-437.370452
Energy at 298.15K	-437.373190
HF Energy	-437.106297
Nuclear repulsion energy	48.532284

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3247	3034	1.88
2	A	3228	3016	10.81
3	A	3131	2925	8.51
4	A	1542	1441	12.08
5	A	1463	1367	8.85
6	A	1419	1326	5.54
7	A	923	863	1.49
8	A	762	712	0.54
9	A	615	575	50.25

Atom	x (Å)	y (Å)	z (Å)
C1	1.105	0.000	-0.007
S2	-0.692	0.000	-0.002
H3	1.426	-0.000	1.034
H4	1.505	-0.891	-0.481
H5	1.505	0.891	-0.481

	C1	S2	H3	H4	H5
C1		1.7965	1.0901	1.0856	1.0856
S2	1.7965		2.3578	2.4182	2.4182
H3	1.0901	2.3578		1.7597	1.7597
H4	1.0856	2.4182	1.7597		1.7824
H5	1.0856	2.4182	1.7597	1.7824

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S2	C1	H3	106.977	S2	C1	H4	111.694
S2	C1	H5	111.696	H3	C1	H4	107.956
H3	C1	H5	107.958	H4	C1	H5	110.358

All results from a given calculation for CH₃S (thiomethoxy)

using model chemistry: MP2=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 CH3S (thiomethoxy)

using model chemistry: MP2=FULL/6-31G**

States and conformations

All results from a given calculation for CH₃S (thiomethoxy)