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	hartrees
Energy at 0K	-229.514566
Energy at 298.15K	-229.521571
Nuclear repulsion energy	133.688125

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3249	3036	0.00
2	A_g	3120	2915	0.00
3	A_g	1584	1480	0.00
4	A_g	1502	1404	0.00
5	A_g	1282	1198	0.00
6	A_g	1102	1030	0.00
7	A_g	834	779	0.00
8	A_g	489	457	0.00
9	A_u	3215	3004	77.90
10	A_u	1527	1427	6.98
11	A_u	1203	1124	2.34
12	A_u	218	204	3.21
13	A_u	19	18	11.90
14	B_g	3215	3004	0.00
15	B_g	1527	1427	0.00
16	B_g	1209	1130	0.00
17	B_g	273	255	0.00
18	B_u	3249	3036	31.15
19	B_u	3118	2914	72.64
20	B_u	1578	1475	19.38
21	B_u	1494	1396	10.94
22	B_u	1197	1118	8.27
23	B_u	1089	1017	92.23
24	B_u	307	287	12.94

Atom	x (Å)	y (Å)	z (Å)
O1	-0.450	0.586	0.000
O2	0.450	-0.586	0.000
C3	0.450	1.681	0.000
C4	-0.450	-1.681	0.000
H5	-0.191	2.559	0.000
H6	1.075	1.673	0.891
H7	1.075	1.673	-0.891
H8	0.191	-2.559	0.000
H9	-1.075	-1.673	0.891
H10	-1.075	-1.673	-0.891

	O1	O2	C3	C4	H5	H6	H7	H8	H9	H10
O1		1.4778	1.4168	2.2672	1.9893	2.0740	2.0740	3.2095	2.5081	2.5081
O2	1.4778		2.2672	1.4168	3.2095	2.5081	2.5081	1.9893	2.0740	2.0740
C3	1.4168	2.2672		3.4801	1.0867	1.0890	1.0890	4.2475	3.7907	3.7907
C4	2.2672	1.4168	3.4801		4.2475	3.7907	3.7907	1.0867	1.0890	1.0890
H5	1.9893	3.2095	1.0867	4.2475		1.7840	1.7840	5.1315	4.4141	4.4141
H6	2.0740	2.5081	1.0890	3.7907	1.7840		1.7827	4.4141	3.9777	4.3589
H7	2.0740	2.5081	1.0890	3.7907	1.7840	1.7827		4.4141	4.3589	3.9777
H8	3.2095	1.9893	4.2475	1.0867	5.1315	4.4141	4.4141		1.7840	1.7840
H9	2.5081	2.0740	3.7907	1.0890	4.4141	3.9777	4.3589	1.7840		1.7827
H10	2.5081	2.0740	3.7907	1.0890	4.4141	4.3589	3.9777	1.7840	1.7827

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	O2	C4	103.100	O1	C3	H5	104.461
O1	C3	H6	111.047	O1	C3	H7	111.047
O2	O1	C3	103.100	O2	C4	H8	104.461
O2	C4	H9	111.047	O2	C4	H10	111.047
H5	C3	H6	110.157	H5	C3	H7	110.157
H6	C3	H7	109.863	H8	C4	H9	110.157
H8	C4	H10	110.157	H9	C4	H10	109.863

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)