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	hartrees
Energy at 0K	-477.374656
Energy at 298.15K
HF Energy	-476.771376
Nuclear repulsion energy	110.904258

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3184	3184	12.39
2	A₁	3081	3081	35.31
3	A₁	1528	1528	0.41
4	A₁	1440	1440	1.23
5	A₁	1095	1095	23.50
6	A₁	732	732	2.92
7	A₁	280	280	0.01
8	A₂	3169	3169	0.00
9	A₂	1499	1499	0.00
10	A₂	996	996	0.00
11	A₂	176	176	0.00
12	B₁	3162	3162	33.79
13	B₁	1512	1512	20.76
14	B₁	1039	1039	16.31
15	B₁	191	191	1.08
16	B₂	3185	3185	4.95
17	B₂	3084	3084	26.11
18	B₂	1518	1518	19.64
19	B₂	1415	1415	0.97
20	B₂	954	954	0.06
21	B₂	785	785	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.665
C2	0.000	1.370	-0.515
C3	0.000	-1.370	-0.515
H4	0.000	2.297	0.058
H5	0.000	-2.297	0.058
H6	0.892	1.350	-1.144
H7	-0.892	1.350	-1.144
H8	-0.892	-1.350	-1.144
H9	0.892	-1.350	-1.144

	S1	C2	C3	H4	H5	H6	H7	H8	H9
S1		1.8078	1.8078	2.3761	2.3761	2.4269	2.4269	2.4269	2.4269
C2	1.8078		2.7390	1.0903	3.7112	1.0915	1.0915	2.9301	2.9301
C3	1.8078	2.7390		3.7112	1.0903	2.9301	2.9301	1.0915	1.0915
H4	2.3761	1.0903	3.7112		4.5944	1.7712	1.7712	3.9421	3.9421
H5	2.3761	3.7112	1.0903	4.5944		3.9421	3.9421	1.7712	1.7712
H6	2.4269	1.0915	2.9301	1.7712	3.9421		1.7836	3.2356	2.6996
H7	2.4269	1.0915	2.9301	1.7712	3.9421	1.7836		2.6996	3.2356
H8	2.4269	2.9301	1.0915	3.9421	1.7712	3.2356	2.6996		1.7836
H9	2.4269	2.9301	1.0915	3.9421	1.7712	2.6996	3.2356	1.7836

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C2	H4	107.557	S1	C2	H6	111.253
S1	C2	H7	111.253	S1	C3	H5	107.557
S1	C3	H8	111.253	S1	C3	H9	111.253
C2	S1	C3	98.498	H4	C2	H6	108.548
H4	C2	H7	108.548	H5	C3	H8	108.548
H5	C3	H9	108.548	H6	C2	H7	109.585
H8	C3	H9	109.585

All results from a given calculation for CH₃SCH₃ (Dimethyl sulfide)

using model chemistry: MP3=FULL/6-311G*

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 CH3SCH3 (Dimethyl sulfide)

using model chemistry: MP3=FULL/6-311G*

States and conformations

All results from a given calculation for CH₃SCH₃ (Dimethyl sulfide)