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	hartrees
Energy at 0K	-228.883256
Energy at 298.15K	-228.889201
HF Energy	-228.248785
Nuclear repulsion energy	124.070398

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3230	3230
2	A'	3162	3162
3	A'	3134	3134
4	A'	1554	1554
5	A'	1543	1543
6	A'	1464	1464
7	A'	1414	1414
8	A'	1208	1208
9	A'	1167	1167
10	A'	1060	1060
11	A'	869	869
12	A'	516	516
13	A'	313	313
14	A"	3250	3250
15	A"	3229	3229
16	A"	1530	1530
17	A"	1302	1302
18	A"	1179	1179
19	A"	821	821
20	A"	225	225
21	A"	58	58

Atom	x (Å)	y (Å)	z (Å)
C1	1.494	0.903	0.000
C2	0.000	0.685	0.000
O3	-0.210	-0.766	0.000
O4	-1.488	-1.056	0.000
H5	1.702	1.972	0.000
H6	1.947	0.462	0.886
H7	1.947	0.462	-0.886
H8	-0.487	1.077	-0.891
H9	-0.487	1.077	0.891

	C1	C2	O3	O4	H5	H6	H7	H8	H9
C1		1.5093	2.3849	3.5671	1.0896	1.0882	1.0882	2.1785	2.1785
C2	1.5093		1.4666	2.2903	2.1340	2.1509	2.1509	1.0882	1.0882
O3	2.3849	1.4666		1.3100	3.3401	2.6360	2.6360	2.0657	2.0657
O4	3.5671	2.2903	1.3100		4.3984	3.8587	3.8587	2.5189	2.5189
H5	1.0896	2.1340	3.3401	4.3984		1.7675	1.7675	2.5274	2.5274
H6	1.0882	2.1509	2.6360	3.8587	1.7675		1.7711	3.0756	2.5106
H7	1.0882	2.1509	2.6360	3.8587	1.7675	1.7711		2.5106	3.0756
H8	2.1785	1.0882	2.0657	2.5189	2.5274	3.0756	2.5106		1.7820
H9	2.1785	1.0882	2.0657	2.5189	2.5274	2.5106	3.0756	1.7820

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.520	C1	C2	H8	113.008
C1	C2	H9	113.008	C2	C1	H5	109.325
C2	C1	H6	110.759	C2	C1	H7	110.759
C2	O3	O4	111.026	O3	C2	H8	106.977
O3	C2	H9	106.977	H5	C1	H6	108.501
H5	C1	H7	108.501	H6	C1	H7	108.935
H8	C2	H9	109.927

All results from a given calculation for C₂H₅OO (ethylperoxy radical)

using model chemistry: ROMP2/6-31+G**

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 C2H5OO (ethylperoxy radical)

using model chemistry: ROMP2/6-31+G**

States and conformations

All results from a given calculation for C₂H₅OO (ethylperoxy radical)