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	hartrees
Energy at 0K	-56.454174
Energy at 298.15K
HF Energy	-55.717350
Nuclear repulsion energy	107.869412

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3232	3069	4.56
2	A₁	3105	2948	7.29
3	A₁	1482	1407	3.65
4	A₁	1391	1321	15.69
5	A₁	1141	1084	179.98
6	A₁	1031	979	0.64
7	A₁	695	660	8.84
8	A₁	462	439	26.21
9	A₁	266	253	1.88
10	A₂	3237	3073	0.00
11	A₂	1474	1399	0.00
12	A₂	962	914	0.00
13	A₂	290	275	0.00
14	A₂	166	158	0.00
15	B₁	3240	3076	9.14
16	B₁	1489	1414	11.40
17	B₁	1315	1248	259.81
18	B₁	1014	963	0.62
19	B₁	349	332	1.59
20	B₁	210	199	0.56
21	B₂	3230	3067	0.03
22	B₂	3103	2946	1.74
23	B₂	1473	1398	7.27
24	B₂	1372	1302	11.93
25	B₂	974	925	58.69
26	B₂	763	724	39.89
27	B₂	444	421	38.93

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.194
O2	-1.293	0.000	0.925
O3	1.293	0.000	0.925
C4	0.000	1.420	-0.930
C5	0.000	-1.420	-0.930
H6	0.000	2.311	-0.282
H7	0.000	-2.311	-0.282
H8	0.913	1.395	-1.546
H9	-0.913	1.395	-1.546
H10	-0.913	-1.395	-1.546
H11	0.913	-1.395	-1.546

	S1	O2	O3	C4	C5	H6	H7	H8	H9	H10	H11
S1		1.4857	1.4857	1.8112	1.8112	2.3594	2.3594	2.4095	2.4095	2.4095	2.4095
O2	1.4857		2.5870	2.6704	2.6704	2.9102	2.9102	3.5942	2.8626	2.8626	3.5942
O3	1.4857	2.5870		2.6704	2.6704	2.9102	2.9102	2.8626	3.5942	3.5942	2.8626
C4	1.8112	2.6704	2.6704		2.8406	1.1017	3.7871	1.1014	1.1014	3.0229	3.0229
C5	1.8112	2.6704	2.6704	2.8406		3.7871	1.1017	3.0229	3.0229	1.1014	1.1014
H6	2.3594	2.9102	2.9102	1.1017	3.7871		4.6219	1.8084	1.8084	4.0206	4.0206
H7	2.3594	2.9102	2.9102	3.7871	1.1017	4.6219		4.0206	4.0206	1.8084	1.8084
H8	2.4095	3.5942	2.8626	1.1014	3.0229	1.8084	4.0206		1.8259	3.3343	2.7899
H9	2.4095	2.8626	3.5942	1.1014	3.0229	1.8084	4.0206	1.8259		2.7899	3.3343
H10	2.4095	2.8626	3.5942	3.0229	1.1014	4.0206	1.8084	3.3343	2.7899		1.8259
H11	2.4095	3.5942	2.8626	3.0229	1.1014	4.0206	1.8084	2.7899	3.3343	1.8259

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C4	H6	105.587	S1	C4	H8	109.200
S1	C4	H9	109.200	S1	C5	H7	105.587
S1	C5	H10	109.200	S1	C5	H11	109.200
O2	S1	O3	121.061	O2	S1	C4	107.776
O2	S1	C5	107.776	O3	S1	C4	107.776
O3	S1	C5	107.776	C4	S1	C5	103.283
H6	C4	H8	110.339	H6	C4	H9	110.339
H7	C5	H10	110.339	H7	C5	H11	110.339
H8	C4	H9	111.965	H10	C5	H11	111.965

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

using model chemistry: MP2/CEP-31G*

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-31G*

States and conformations

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