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	hartrees
Energy at 0K	-474.805472
Energy at 298.15K
HF Energy	-474.455846
Nuclear repulsion energy	109.927848

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3126	2990	11.33
2	A₁	3041	2909	23.60
3	A₁	1574	1505	0.46
4	A₁	1461	1398	0.61
5	A₁	1109	1061	18.24
6	A₁	691	661	2.58
7	A₁	276	264	0.05
8	A₂	3116	2980	0.00
9	A₂	1550	1483	0.00
10	A₂	1018	974	0.00
11	A₂	192	184	0.00
12	B₁	3112	2976	31.59
13	B₁	1559	1492	18.92
14	B₁	1051	1005	8.18
15	B₁	190	181	1.04
16	B₂	3126	2990	4.98
17	B₂	3044	2911	21.47
18	B₂	1566	1498	17.59
19	B₂	1440	1377	1.29
20	B₂	978	935	0.31
21	B₂	742	710	0.09

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.673
C2	0.000	1.383	-0.521
C3	0.000	-1.383	-0.521
H4	0.000	2.317	0.054
H5	0.000	-2.317	0.054
H6	0.897	1.353	-1.153
H7	-0.897	1.353	-1.153
H8	-0.897	-1.353	-1.153
H9	0.897	-1.353	-1.153

	S1	C2	C3	H4	H5	H6	H7	H8	H9
S1		1.8271	1.8271	2.3986	2.3986	2.4429	2.4429	2.4429	2.4429
C2	1.8271		2.7661	1.0969	3.7448	1.0972	1.0972	2.9480	2.9480
C3	1.8271	2.7661		3.7448	1.0969	2.9480	2.9480	1.0972	1.0972
H4	2.3986	1.0969	3.7448		4.6347	1.7858	1.7858	3.9665	3.9665
H5	2.3986	3.7448	1.0969	4.6347		3.9665	3.9665	1.7858	1.7858
H6	2.4429	1.0972	2.9480	1.7858	3.9665		1.7933	3.2467	2.7065
H7	2.4429	1.0972	2.9480	1.7858	3.9665	1.7933		2.7065	3.2467
H8	2.4429	2.9480	1.0972	3.9665	1.7858	3.2467	2.7065		1.7933
H9	2.4429	2.9480	1.0972	3.9665	1.7858	2.7065	3.2467	1.7933

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C2	H4	107.597	S1	C2	H6	110.832
S1	C2	H7	110.832	S1	C3	H5	107.597
S1	C3	H8	110.832	S1	C3	H9	110.832
C2	S1	C3	98.399	H4	C2	H6	108.957
H4	C2	H7	108.957	H5	C3	H8	108.957
H5	C3	H9	108.957	H6	C2	H7	109.607
H8	C3	H9	109.607

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

using model chemistry: CCD/3-21G*

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: CCD/3-21G*

States and conformations

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