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	hartrees
Energy at 0K	-552.177105
Energy at 298.15K	-552.184116
HF Energy	-551.553443
Nuclear repulsion energy	183.155897

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3255	3062	2.02	92.22	0.72	0.84
2	A'	3242	3049	7.08	94.86	0.75	0.86
3	A'	3122	2937	8.14	245.12	0.00	0.00
4	A'	1514	1424	23.83	1.75	0.67	0.80
5	A'	1494	1406	4.80	13.11	0.69	0.82
6	A'	1404	1321	9.11	5.31	0.02	0.03
7	A'	1102	1037	162.99	7.34	0.49	0.66
8	A'	1066	1003	13.61	1.70	0.74	0.85
9	A'	996	937	20.18	3.48	0.74	0.85
10	A'	696	655	7.90	32.27	0.14	0.24
11	A'	373	351	9.90	1.77	0.15	0.27
12	A'	296	279	0.65	2.59	0.75	0.86
13	A'	245	231	0.34	0.08	0.72	0.84
14	A"	3255	3061	0.62	38.41	0.75	0.86
15	A"	3239	3046	0.02	7.97	0.75	0.86
16	A"	3121	2936	4.25	0.37	0.75	0.86
17	A"	1498	1409	0.09	16.20	0.75	0.86
18	A"	1481	1393	10.77	1.88	0.75	0.86
19	A"	1381	1299	2.38	0.19	0.75	0.86
20	A"	969	911	5.52	1.50	0.75	0.86
21	A"	933	878	1.08	0.05	0.75	0.86
22	A"	727	684	18.36	20.25	0.75	0.86
23	A"	310	292	9.82	5.06	0.75	0.86
24	A"	185	174	0.01	0.00	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
S1	0.262	0.425	0.000
O2	-1.110	1.081	0.000
C3	0.262	-0.784	1.345
C4	0.262	-0.784	-1.345
H5	1.175	-1.378	1.310
H6	1.175	-1.378	-1.310
H7	0.218	-0.228	2.278
H8	0.218	-0.228	-2.278
H9	-0.622	-1.413	1.252
H10	-0.622	-1.413	-1.252

	S1	O2	C3	C4	H5	H6	H7	H8	H9	H10
S1		1.5209	1.8078	1.8078	2.4079	2.4079	2.3704	2.3704	2.3928	2.3928
O2	1.5209		2.6772	2.6772	3.6029	3.6029	2.9442	2.9442	2.8328	2.8328
C3	1.8078	2.6772		2.6898	1.0896	2.8695	1.0873	3.6659	1.0894	2.8143
C4	1.8078	2.6772	2.6898		2.8695	1.0896	3.6659	1.0873	2.8143	1.0894
H5	2.4079	3.6029	1.0896	2.8695		2.6199	1.7818	3.8876	1.7979	3.1291
H6	2.4079	3.6029	2.8695	1.0896	2.6199		3.8876	1.7818	3.1291	1.7979
H7	2.3704	2.9442	1.0873	3.6659	1.7818	3.8876		4.5568	1.7792	3.8174
H8	2.3704	2.9442	3.6659	1.0873	3.8876	1.7818	4.5568		3.8174	1.7792
H9	2.3928	2.8328	1.0894	2.8143	1.7979	3.1291	1.7792	3.8174		2.5033
H10	2.3928	2.8328	2.8143	1.0894	3.1291	1.7979	3.8174	1.7792	2.5033

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	H5	109.924	S1	C3	H7	107.289
S1	C3	H9	108.817	S1	C4	H6	109.924
S1	C4	H8	107.289	S1	C4	H10	108.817
O2	S1	C3	106.759	O2	S1	C4	106.759
C3	S1	C4	96.133	H5	C3	H7	109.876
H5	C3	H9	111.198	H6	C4	H8	109.876
H6	C4	H10	111.198	H7	C3	H9	109.649
H8	C4	H10	109.649

All results from a given calculation for CH₃SOCH₃ (Dimethyl sulfoxide)

using model chemistry: MP2/6-31+G**

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 CH3SOCH3 (Dimethyl sulfoxide)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for CH₃SOCH₃ (Dimethyl sulfoxide)