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	hartrees
Energy at 0K	-229.390888
Energy at 298.15K	-229.398004
Nuclear repulsion energy	134.985218

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3269	3020	0.00
2	A_g	3161	2920	0.00
3	A_g	1612	1489	0.00
4	A_g	1550	1432	0.00
5	A_g	1344	1242	0.00
6	A_g	1202	1111	0.00
7	A_g	934	862	0.00
8	A_g	519	479	0.00
9	A_u	3239	2992	82.43
10	A_u	1563	1444	8.23
11	A_u	1240	1146	2.87
12	A_u	222	205	3.42
13	A_u	21	19	13.48
14	B_g	3239	2992	0.00
15	B_g	1563	1444	0.00
16	B_g	1245	1150	0.00
17	B_g	279	258	0.00
18	B_u	3269	3020	38.04
19	B_u	3157	2917	75.60
20	B_u	1606	1483	19.20
21	B_u	1541	1423	11.73
22	B_u	1245	1150	9.36
23	B_u	1147	1059	132.45
24	B_u	323	299	12.60

Atom	x (Å)	y (Å)	z (Å)
O1	-0.434	0.570	0.000
O2	0.434	-0.570	0.000
C3	0.434	1.678	0.000
C4	-0.434	-1.678	0.000
H5	-0.218	2.547	0.000
H6	1.060	1.679	0.891
H7	1.060	1.679	-0.891
H8	0.218	-2.547	0.000
H9	-1.060	-1.679	0.891
H10	-1.060	-1.679	-0.891

	O1	O2	C3	C4	H5	H6	H7	H8	H9	H10
O1		1.4322	1.4074	2.2472	1.9891	2.0632	2.0632	3.1842	2.4988	2.4988
O2	1.4322		2.2472	1.4074	3.1842	2.4988	2.4988	1.9891	2.0632	2.0632
C3	1.4074	2.2472		3.4655	1.0869	1.0892	1.0892	4.2301	3.7808	3.7808
C4	2.2472	1.4074	3.4655		4.2301	3.7808	3.7808	1.0869	1.0892	1.0892
H5	1.9891	3.1842	1.0869	4.2301		1.7835	1.7835	5.1128	4.4006	4.4006
H6	2.0632	2.4988	1.0892	3.7808	1.7835		1.7830	4.4006	3.9714	4.3533
H7	2.0632	2.4988	1.0892	3.7808	1.7835	1.7830		4.4006	4.3533	3.9714
H8	3.1842	1.9891	4.2301	1.0869	5.1128	4.4006	4.4006		1.7835	1.7835
H9	2.4988	2.0632	3.7808	1.0892	4.4006	3.9714	4.3533	1.7835		1.7830
H10	2.4988	2.0632	3.7808	1.0892	4.4006	4.3533	3.9714	1.7835	1.7830

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	O2	C4	104.628	O1	C3	H5	105.055
O1	C3	H6	110.827	O1	C3	H7	110.827
O2	O1	C3	104.628	O2	C4	H8	105.055
O2	C4	H9	110.827	O2	C4	H10	110.827
H5	C3	H6	110.085	H5	C3	H7	110.085
H6	C3	H7	109.871	H8	C4	H9	110.085
H8	C4	H10	110.085	H9	C4	H10	109.871

All results from a given calculation for CH₃OOCH₃ (dimethylperoxide)

using model chemistry: CID/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: CID/6-31G*

States and conformations

All results from a given calculation for CH₃OOCH₃ (dimethylperoxide)