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	hartrees
Energy at 0K	-477.269539
Energy at 298.15K
HF Energy	-476.780647
Nuclear repulsion energy	110.834771

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3169	3026	14.59
2	A₁	3067	2929	35.79
3	A₁	1512	1444	0.01
4	A₁	1423	1359	3.07
5	A₁	1079	1031	17.93
6	A₁	733	700	2.42
7	A₁	276	263	0.00
8	A₂	3153	3011	0.00
9	A₂	1475	1409	0.00
10	A₂	983	939	0.00
11	A₂	161	153	0.00
12	B₁	3147	3006	38.13
13	B₁	1485	1419	13.37
14	B₁	1028	982	11.30
15	B₁	187	178	0.85
16	B₂	3169	3027	6.57
17	B₂	3069	2932	28.33
18	B₂	1500	1433	15.07
19	B₂	1398	1335	5.03
20	B₂	939	897	0.00
21	B₂	786	751	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.666
C2	0.000	1.369	-0.516
C3	0.000	-1.369	-0.516
H4	0.000	2.299	0.059
H5	0.000	-2.299	0.059
H6	0.894	1.349	-1.146
H7	-0.894	1.349	-1.146
H8	-0.894	-1.349	-1.146
H9	0.894	-1.349	-1.146

	S1	C2	C3	H4	H5	H6	H7	H8	H9
S1		1.8082	1.8082	2.3777	2.3777	2.4288	2.4288	2.4288	2.4288
C2	1.8082		2.7379	1.0928	3.7124	1.0939	1.0939	2.9293	2.9293
C3	1.8082	2.7379		3.7124	1.0928	2.9293	2.9293	1.0939	1.0939
H4	2.3777	1.0928	3.7124		4.5977	1.7755	1.7755	3.9437	3.9437
H5	2.3777	3.7124	1.0928	4.5977		3.9437	3.9437	1.7755	1.7755
H6	2.4288	1.0939	2.9293	1.7755	3.9437		1.7880	3.2359	2.6971
H7	2.4288	1.0939	2.9293	1.7755	3.9437	1.7880		2.6971	3.2359
H8	2.4288	2.9293	1.0939	3.9437	1.7755	3.2359	2.6971		1.7880
H9	2.4288	2.9293	1.0939	3.9437	1.7755	2.6971	3.2359	1.7880

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C2	H4	107.515	S1	C2	H6	111.236
S1	C2	H7	111.236	S1	C3	H5	107.515
S1	C3	H8	111.236	S1	C3	H9	111.236
C2	S1	C3	98.413	H4	C2	H6	108.570
H4	C2	H7	108.570	H5	C3	H8	108.570
H5	C3	H9	108.570	H6	C2	H7	109.620
H8	C3	H9	109.620

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

using model chemistry: CCD/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: CCD/6-311G**

States and conformations

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