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	hartrees
Energy at 0K	-55.965937
Energy at 298.15K
HF Energy	-55.460559
Nuclear repulsion energy	101.448968

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3175	3099	0.13
2	A₁	3013	2941	6.60
3	A₁	1459	1424	6.54
4	A₁	1393	1359	1.10
5	A₁	1074	1048	41.35
6	A₁	811	792	76.25
7	A₁	583	569	4.59
8	A₁	342	334	27.98
9	A₁	204	199	3.31
10	A₂	3175	3099	0.00
11	A₂	1462	1427	0.00
12	A₂	984	960	0.00
13	A₂	228	222	0.00
14	A₂	154	150	0.00
15	B₁	3177	3101	1.22
16	B₁	1473	1437	20.98
17	B₁	1071	1046	66.30
18	B₁	912	891	87.34
19	B₁	270	264	2.02
20	B₁	178	174	0.97
21	B₂	3173	3097	0.60
22	B₂	3012	2939	0.91
23	B₂	1451	1416	9.05
24	B₂	1366	1334	0.01
25	B₂	986	963	12.56
26	B₂	677	661	25.90
27	B₂	329	321	57.33

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.167
O2	-1.443	0.000	0.973
O3	1.443	0.000	0.973
C4	0.000	1.531	-0.959
C5	0.000	-1.531	-0.959
H6	0.000	2.378	-0.263
H7	0.000	-2.378	-0.263
H8	0.919	1.493	-1.555
H9	-0.919	1.493	-1.555
H10	-0.919	-1.493	-1.555
H11	0.919	-1.493	-1.555

	S1	O2	O3	C4	C5	H6	H7	H8	H9	H10	H11
S1		1.6533	1.6533	1.9006	1.9006	2.4168	2.4168	2.4578	2.4578	2.4578	2.4578
O2	1.6533		2.8868	2.8567	2.8567	3.0443	3.0443	3.7689	2.9831	2.9831	3.7689
O3	1.6533	2.8868		2.8567	2.8567	3.0443	3.0443	2.9831	3.7689	3.7689	2.9831
C4	1.9006	2.8567	2.8567		3.0623	1.0962	3.9708	1.0964	1.0964	3.2164	3.2164
C5	1.9006	2.8567	2.8567	3.0623		3.9708	1.0962	3.2164	3.2164	1.0964	1.0964
H6	2.4168	3.0443	3.0443	1.0962	3.9708		4.7564	1.8163	1.8163	4.1833	4.1833
H7	2.4168	3.0443	3.0443	3.9708	1.0962	4.7564		4.1833	4.1833	1.8163	1.8163
H8	2.4578	3.7689	2.9831	1.0964	3.2164	1.8163	4.1833		1.8379	3.5060	2.9857
H9	2.4578	2.9831	3.7689	1.0964	3.2164	1.8163	4.1833	1.8379		2.9857	3.5060
H10	2.4578	2.9831	3.7689	3.2164	1.0964	4.1833	1.8163	3.5060	2.9857		1.8379
H11	2.4578	3.7689	2.9831	3.2164	1.0964	4.1833	1.8163	2.9857	3.5060	1.8379

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C4	H6	104.271	S1	C4	H8	107.114
S1	C4	H9	107.114	S1	C5	H7	104.271
S1	C5	H10	107.114	S1	C5	H11	107.114
O2	S1	O3	121.632	O2	S1	C4	106.790
O2	S1	C5	106.790	O3	S1	C4	106.790
O3	S1	C5	106.790	C4	S1	C5	107.343
H6	C4	H8	111.869	H6	C4	H9	111.869
H7	C5	H10	111.869	H7	C5	H11	111.869
H8	C4	H9	113.895	H10	C5	H11	113.895

All results from a given calculation for C₂H₆O₂S (Dimethyl sulfone)

using model chemistry: MP2/CEP-121G

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 C2H6O2S (Dimethyl sulfone)

using model chemistry: MP2/CEP-121G

States and conformations

All results from a given calculation for C₂H₆O₂S (Dimethyl sulfone)