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	hartrees
Energy at 0K	-229.465520
Energy at 298.15K	-229.472525
Nuclear repulsion energy	133.501492

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3222	3035	0.00
2	A_g	3100	2921	0.00
3	A_g	1582	1490	0.00
4	A_g	1505	1418	0.00
5	A_g	1282	1208	0.00
6	A_g	1102	1038	0.00
7	A_g	833	785	0.00
8	A_g	490	462	0.00
9	A_u	3189	3005	72.59
10	A_u	1528	1440	8.59
11	A_u	1205	1135	1.43
12	A_u	221	208	3.56
13	A_u	20	19	12.41
14	B_g	3189	3005	0.00
15	B_g	1528	1440	0.00
16	B_g	1210	1140	0.00
17	B_g	277	261	0.00
18	B_u	3222	3035	28.13
19	B_u	3099	2919	65.63
20	B_u	1576	1485	19.91
21	B_u	1498	1411	6.35
22	B_u	1199	1130	6.51
23	B_u	1087	1024	95.15
24	B_u	308	290	13.75

Atom	x (Å)	y (Å)	z (Å)
O1	-0.450	0.586	0.000
O2	0.450	-0.586	0.000
C3	0.450	1.683	0.000
C4	-0.450	-1.683	0.000
H5	-0.196	2.563	0.000
H6	1.077	1.674	0.896
H7	1.077	1.674	-0.896
H8	0.196	-2.563	0.000
H9	-1.077	-1.674	0.896
H10	-1.077	-1.674	-0.896

	O1	O2	C3	C4	H5	H6	H7	H8	H9	H10
O1		1.4774	1.4184	2.2690	1.9929	2.0779	2.0779	3.2144	2.5111	2.5111
O2	1.4774		2.2690	1.4184	3.2144	2.5111	2.5111	1.9929	2.0779	2.0779
C3	1.4184	2.2690		3.4839	1.0915	1.0937	1.0937	4.2532	3.7953	3.7953
C4	2.2690	1.4184	3.4839		4.2532	3.7953	3.7953	1.0915	1.0937	1.0937
H5	1.9929	3.2144	1.0915	4.2532		1.7926	1.7926	5.1406	4.4194	4.4194
H6	2.0779	2.5111	1.0937	3.7953	1.7926		1.7917	4.4194	3.9817	4.3662
H7	2.0779	2.5111	1.0937	3.7953	1.7926	1.7917		4.4194	4.3662	3.9817
H8	3.2144	1.9929	4.2532	1.0915	5.1406	4.4194	4.4194		1.7926	1.7926
H9	2.5111	2.0779	3.7953	1.0937	4.4194	3.9817	4.3662	1.7926		1.7917
H10	2.5111	2.0779	3.7953	1.0937	4.4194	4.3662	3.9817	1.7926	1.7917

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	O2	C4	103.151	O1	C3	H5	104.363
O1	C3	H6	110.955	O1	C3	H7	110.955
O2	O1	C3	103.151	O2	C4	H8	104.363
O2	C4	H9	110.955	O2	C4	H10	110.955
H5	C3	H6	110.231	H5	C3	H7	110.231
H6	C3	H7	109.988	H8	C4	H9	110.231
H8	C4	H10	110.231	H9	C4	H10	109.988

All results from a given calculation for CH₃OOCH₃ (dimethylperoxide)

using model chemistry: MP2=FULL/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: MP2=FULL/6-31G*

States and conformations

All results from a given calculation for CH₃OOCH₃ (dimethylperoxide)