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	hartrees
Energy at 0K	-226.127366
Energy at 298.15K	-226.134172
Nuclear repulsion energy	131.361986

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3530	3138	0.00
2	A_g	3329	2959	0.00
3	A_g	1719	1528	0.00
4	A_g	1623	1443	0.00
5	A_g	1370	1218	0.00
6	A_g	1285	1143	0.00
7	A_g	1008	896	0.00
8	A_g	517	460	0.00
9	A_u	3494	3106	15.41
10	A_u	1685	1498	2.69
11	A_u	1208	1074	3.80
12	A_u	182	162	1.24
13	A_u	40	36	5.87
14	B_g	3494	3106	0.00
15	B_g	1685	1498	0.00
16	B_g	1212	1077	0.00
17	B_g	223	198	0.00
18	B_u	3530	3138	2.93
19	B_u	3328	2958	14.86
20	B_u	1716	1525	9.17
21	B_u	1605	1427	21.96
22	B_u	1233	1096	0.32
23	B_u	1167	1037	6.53
24	B_u	322	286	3.63

Atom	x (Å)	y (Å)	z (Å)
O1	-0.463	0.566	0.000
O2	0.463	-0.566	0.000
C3	0.463	1.709	0.000
C4	-0.463	-1.709	0.000
H5	-0.169	2.619	0.000
H6	1.112	1.716	0.902
H7	1.112	1.716	-0.902
H8	0.169	-2.619	0.000
H9	-1.112	-1.716	0.902
H10	-1.112	-1.716	-0.902

	O1	O2	C3	C4	H5	H6	H7	H8	H9	H10
O1		1.4628	1.4709	2.2746	2.0739	2.1490	2.1490	3.2470	2.5383	2.5383
O2	1.4628		2.2746	1.4709	3.2470	2.5383	2.5383	2.0739	2.1490	2.1490
C3	1.4709	2.2746		3.5405	1.1081	1.1116	1.1116	4.3375	3.8760	3.8760
C4	2.2746	1.4709	3.5405		4.3375	3.8760	3.8760	1.1081	1.1116	1.1116
H5	2.0739	3.2470	1.1081	4.3375		1.8083	1.8083	5.2487	4.5272	4.5272
H6	2.1490	2.5383	1.1116	3.8760	1.8083		1.8049	4.5272	4.0896	4.4702
H7	2.1490	2.5383	1.1116	3.8760	1.8083	1.8049		4.5272	4.4702	4.0896
H8	3.2470	2.0739	4.3375	1.1081	5.2487	4.5272	4.5272		1.8083	1.8083
H9	2.5383	2.1490	3.8760	1.1116	4.5272	4.0896	4.4702	1.8083		1.8049
H10	2.5383	2.1490	3.8760	1.1116	4.5272	4.4702	4.0896	1.8083	1.8049

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	O2	C4	101.667	O1	C3	H5	106.203
O1	C3	H6	111.889	O1	C3	H7	111.889
O2	O1	C3	101.667	O2	C4	H8	106.203
O2	C4	H9	111.889	O2	C4	H10	111.889
H5	C3	H6	109.109	H5	C3	H7	109.109
H6	C3	H7	108.565	H8	C4	H9	109.109
H8	C4	H10	109.109	H9	C4	H10	108.565

All results from a given calculation for CH₃OOCH₃ (dimethylperoxide)

using model chemistry: MP2=FULL/STO-3G

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/STO-3G

States and conformations

All results from a given calculation for CH₃OOCH₃ (dimethylperoxide)