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	hartrees
Energy at 0K	-189.682234
Energy at 298.15K	-189.685883
HF Energy	-189.206195
Nuclear repulsion energy	75.041333

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3286	3077	7.80
2	A'	3155	2955	17.89
3	A'	1551	1452	9.37
4	A'	1498	1403	0.24
5	A'	1272	1192	101.79
6	A'	1218	1141	0.65
7	A'	966	904	16.95
8	A'	504	472	6.73
9	A"	3276	3068	13.21
10	A"	1539	1441	5.26
11	A"	1167	1093	0.99
12	A"	132	124	0.28

Atom	x (Å)	y (Å)	z (Å)
C1	0.994	-0.483	0.000
O2	0.000	0.573	0.000
O3	-1.207	0.057	0.000
H4	1.951	0.028	0.000
H5	0.870	-1.086	0.894
H6	0.870	-1.086	-0.894

	C1	O2	O3	H4	H5	H6
C1		1.4503	2.2655	1.0851	1.0857	1.0857
O2	1.4503		1.3125	2.0257	2.0762	2.0762
O3	2.2655	1.3125		3.1576	2.5333	2.5333
H4	1.0851	2.0257	3.1576		1.7917	1.7917
H5	1.0857	2.0762	2.5333	1.7917		1.7883
H6	1.0857	2.0762	2.5333	1.7917	1.7883

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	110.070	O2	C1	H4	105.145
O2	C1	H5	109.059	O2	C1	H6	109.059
H4	C1	H5	111.245	H4	C1	H6	111.245
H5	C1	H6	110.888

All results from a given calculation for CH₃OO (methylperoxy radical)

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

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 CH3OO (methylperoxy radical)

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

States and conformations

All results from a given calculation for CH₃OO (methylperoxy radical)