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	hartrees
Energy at 0K	-474.767694
Energy at 298.15K
HF Energy	-474.456543
Nuclear repulsion energy	110.366821

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3194	2972	10.29
2	A₁	3110	2894	24.08
3	A₁	1603	1492	0.71
4	A₁	1491	1388	0.51
5	A₁	1133	1055	19.69
6	A₁	709	660	3.02
7	A₁	280	260	0.04
8	A₂	3184	2963	0.00
9	A₂	1580	1470	0.00
10	A₂	1037	965	0.00
11	A₂	195	181	0.00
12	B₁	3180	2959	29.64
13	B₁	1589	1479	20.90
14	B₁	1071	996	8.53
15	B₁	194	180	1.12
16	B₂	3194	2972	4.23
17	B₂	3110	2894	22.11
18	B₂	1595	1484	18.93
19	B₂	1470	1367	1.02
20	B₂	996	927	0.31
21	B₂	762	709	0.14

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.668
C2	0.000	1.381	-0.518
C3	0.000	-1.381	-0.518
H4	0.000	2.309	0.056
H5	0.000	-2.309	0.056
H6	0.892	1.353	-1.146
H7	-0.892	1.353	-1.146
H8	-0.892	-1.353	-1.146
H9	0.892	-1.353	-1.146

	S1	C2	C3	H4	H5	H6	H7	H8	H9
S1		1.8197	1.8197	2.3884	2.3884	2.4326	2.4326	2.4326	2.4326
C2	1.8197		2.7610	1.0914	3.7337	1.0917	1.0917	2.9434	2.9434
C3	1.8197	2.7610		3.7337	1.0914	2.9434	2.9434	1.0917	1.0917
H4	2.3884	1.0914	3.7337		4.6175	1.7765	1.7765	3.9561	3.9561
H5	2.3884	3.7337	1.0914	4.6175		3.9561	3.9561	1.7765	1.7765
H6	2.4326	1.0917	2.9434	1.7765	3.9561		1.7842	3.2413	2.7061
H7	2.4326	1.0917	2.9434	1.7765	3.9561	1.7842		2.7061	3.2413
H8	2.4326	2.9434	1.0917	3.9561	1.7765	3.2413	2.7061		1.7842
H9	2.4326	2.9434	1.0917	3.9561	1.7765	2.7061	3.2413	1.7842

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C2	H4	107.613	S1	C2	H6	110.859
S1	C2	H7	110.859	S1	C3	H5	107.613
S1	C3	H8	110.859	S1	C3	H9	110.859
C2	S1	C3	98.693	H4	C2	H6	108.923
H4	C2	H7	108.923	H5	C3	H8	108.923
H5	C3	H9	108.923	H6	C2	H7	109.603
H8	C3	H9	109.603

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

using model chemistry: CID/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: CID/3-21G*

States and conformations

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