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	hartrees
Energy at 0K	-477.292940
Energy at 298.15K
HF Energy	-476.785276
Nuclear repulsion energy	110.229647

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3160	3042
2	A₁	3053	2938
3	A₁	1498	1441
4	A₁	1405	1353
5	A₁	1062	1022
6	A₁	703	676
7	A₁	265	255
8	A₂	3142	3024
9	A₂	1457	1402
10	A₂	956	920
11	A₂	122	117
12	B₁	3135	3017
13	B₁	1467	1412
14	B₁	1004	967
15	B₁	181	174
16	B₂	3161	3042
17	B₂	3056	2941
18	B₂	1484	1429
19	B₂	1377	1326
20	B₂	925	891
21	B₂	752	724

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.675
C2	0.000	1.375	-0.524
C3	0.000	-1.375	-0.524
H4	0.000	2.305	0.045
H5	0.000	-2.305	0.045
H6	0.893	1.346	-1.151
H7	-0.893	1.346	-1.151
H8	-0.893	-1.346	-1.151
H9	0.893	-1.346	-1.151

	S1	C2	C3	H4	H5	H6	H7	H8	H9
S1		1.8248	1.8248	2.3899	2.3899	2.4382	2.4382	2.4382	2.4382
C2	1.8248		2.7509	1.0904	3.7247	1.0917	1.0917	2.9320	2.9320
C3	1.8248	2.7509		3.7247	1.0904	2.9320	2.9320	1.0917	1.0917
H4	2.3899	1.0904	3.7247		4.6109	1.7749	1.7749	3.9448	3.9448
H5	2.3899	3.7247	1.0904	4.6109		3.9448	3.9448	1.7749	1.7749
H6	2.4382	1.0917	2.9320	1.7749	3.9448		1.7861	3.2304	2.6917
H7	2.4382	1.0917	2.9320	1.7749	3.9448	1.7861		2.6917	3.2304
H8	2.4382	2.9320	1.0917	3.9448	1.7749	3.2304	2.6917		1.7861
H9	2.4382	2.9320	1.0917	3.9448	1.7749	2.6917	3.2304	1.7861

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C2	H4	107.441	S1	C2	H6	110.923
S1	C2	H7	110.923	S1	C3	H5	107.441
S1	C3	H8	110.923	S1	C3	H9	110.923
C2	S1	C3	97.835	H4	C2	H6	108.852
H4	C2	H7	108.852	H5	C3	H8	108.852
H5	C3	H9	108.852	H6	C2	H7	109.775
H8	C3	H9	109.775

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

using model chemistry: CCSD(T)/TZVP

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: CCSD(T)/TZVP

States and conformations

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