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	hartrees
Energy at 0K	-189.825491
Energy at 298.15K	-189.829179
HF Energy	-189.254897
Nuclear repulsion energy	75.566721

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3239	3072	7.11
2	A'	3113	2953	17.63
3	A'	1515	1437	14.49
4	A'	1488	1411	0.32
5	A'	1290	1224	89.38
6	A'	1218	1155	1.10
7	A'	978	927	15.77
8	A'	516	489	6.95
9	A"	3223	3057	13.32
10	A"	1499	1422	8.29
11	A"	1167	1107	1.17
12	A"	145	138	0.23

Atom	x (Å)	y (Å)	z (Å)
C1	0.985	-0.489	0.000
O2	0.000	0.565	0.000
O3	-1.197	0.073	0.000
H4	1.948	0.018	0.000
H5	0.859	-1.094	0.897
H6	0.859	-1.094	-0.897

	C1	O2	O3	H4	H5	H6
C1		1.4421	2.2527	1.0884	1.0894	1.0894
O2	1.4421		1.2939	2.0237	2.0722	2.0722
O3	2.2527	1.2939		3.1456	2.5282	2.5282
H4	1.0884	2.0237	3.1456		1.7966	1.7966
H5	1.0894	2.0722	2.5282	1.7966		1.7934
H6	1.0894	2.0722	2.5282	1.7966	1.7934

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	110.732	O2	C1	H4	105.353
O2	C1	H5	109.092	O2	C1	H6	109.092
H4	C1	H5	111.165	H4	C1	H6	111.165
H5	C1	H6	110.794

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

using model chemistry: MP2=FULL/6-311G**

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=FULL/6-311G**

States and conformations

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