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	hartrees
Energy at 0K	-189.946849
Energy at 298.15K	-189.942086
HF Energy	-189.202313
Nuclear repulsion energy	75.954841

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3345	3151	21.78
2	A'	3243	3055	28.27
3	A'	1647	1552	8.07
4	A'	1612	1519	3.16
5	A'	1343	1266	11.82
6	A'	1280	1206	67.18
7	A'	1064	1003	30.91
8	A'	535	504	4.55
9	A"	3329	3136	37.00
10	A"	1631	1537	4.24
11	A"	1280	1206	2.92
12	A"	181	171	1.37

Atom	x (Å)	y (Å)	z (Å)
C1	0.993	-0.484	0.000
O2	0.000	0.573	0.000
O3	-1.206	0.059	0.000
H4	1.953	0.030	0.000
H5	0.868	-1.088	0.898
H6	0.868	-1.088	-0.898

	C1	O2	O3	H4	H5	H6
C1		1.4507	2.2657	1.0888	1.0893	1.0893
O2	1.4507		1.3114	2.0275	2.0781	2.0781
O3	2.2657	1.3114		3.1597	2.5344	2.5344
H4	1.0888	2.0275	3.1597		1.7983	1.7983
H5	1.0893	2.0781	2.5344	1.7983		1.7954
H6	1.0893	2.0781	2.5344	1.7983	1.7954

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	110.884	O2	C1	H4	105.610
O2	C1	H5	110.028	O2	C1	H6	110.028
H4	C1	H5	110.347	H4	C1	H6	110.347
H5	C1	H6	110.380

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

using model chemistry: G2

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: G2

States and conformations

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