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	hartrees
Energy at 0K	-230.027469
Energy at 298.15K	-230.034357
Nuclear repulsion energy	131.414256

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3192	3022	0.00
2	A_g	3076	2912	0.00
3	A_g	1566	1483	0.00
4	A_g	1484	1405	0.00
5	A_g	1257	1190	0.00
6	A_g	1048	992	0.00
7	A_g	817	773	0.00
8	A_g	465	440	0.00
9	A_u	3168	2999	79.57
10	A_u	1509	1428	18.52
11	A_u	1179	1116	0.09
12	A_u	191	180	4.63
13	A_u	44	42	17.80
14	B_g	3167	2998	0.00
15	B_g	1509	1428	0.00
16	B_g	1182	1119	0.00
17	B_g	239	226	0.00
18	B_u	3192	3022	26.10
19	B_u	3073	2909	65.89
20	B_u	1560	1477	28.42
21	B_u	1475	1396	0.84
22	B_u	1172	1109	5.04
23	B_u	1037	982	75.92
24	B_u	283	268	15.58

Atom	x (Å)	y (Å)	z (Å)
O1	-0.454	0.606	0.000
O2	0.454	-0.606	0.000
C3	0.454	1.721	0.000
C4	-0.454	-1.721	0.000
H5	-0.196	2.598	0.000
H6	1.080	1.715	0.895
H7	1.080	1.715	-0.895
H8	0.196	-2.598	0.000
H9	-1.080	-1.715	0.895
H10	-1.080	-1.715	-0.895

	O1	O2	C3	C4	H5	H6	H7	H8	H9	H10
O1		1.5139	1.4382	2.3267	2.0087	2.0942	2.0942	3.2687	2.5653	2.5653
O2	1.5139		2.3267	1.4382	3.2687	2.5653	2.5653	2.0087	2.0942	2.0942
C3	1.4382	2.3267		3.5598	1.0914	1.0923	1.0923	4.3265	3.8682	3.8682
C4	2.3267	1.4382	3.5598		4.3265	3.8682	3.8682	1.0914	1.0923	1.0923
H5	2.0087	3.2687	1.0914	4.3265		1.7909	1.7909	5.2102	4.4929	4.4929
H6	2.0942	2.5653	1.0923	3.8682	1.7909		1.7904	4.4929	4.0540	4.4318
H7	2.0942	2.5653	1.0923	3.8682	1.7909	1.7904		4.4929	4.4318	4.0540
H8	3.2687	2.0087	4.3265	1.0914	5.2102	4.4929	4.4929		1.7909	1.7909
H9	2.5653	2.0942	3.8682	1.0923	4.4929	4.0540	4.4318	1.7909		1.7904
H10	2.5653	2.0942	3.8682	1.0923	4.4929	4.4318	4.0540	1.7909	1.7904

All results from a given calculation for CH₃OOCH₃ (dimethylperoxide)

using model chemistry: mPW1PW91/6-31G

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 CH3OOCH3 (dimethylperoxide)

using model chemistry: mPW1PW91/6-31G

States and conformations

All results from a given calculation for CH₃OOCH₃ (dimethylperoxide)