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	hartrees
Energy at 0K	-228.829683
Energy at 298.15K	-228.835713
HF Energy	-228.235586
Nuclear repulsion energy	124.095596

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3218	3218
2	A'	3144	3144
3	A'	3125	3125
4	A'	1572	1572
5	A'	1562	1562
6	A'	1479	1479
7	A'	1422	1422
8	A'	1221	1221
9	A'	1180	1180
10	A'	1072	1072
11	A'	884	884
12	A'	519	519
13	A'	318	318
14	A"	3229	3229
15	A"	3208	3208
16	A"	1550	1550
17	A"	1315	1315
18	A"	1198	1198
19	A"	833	833
20	A"	255	255
21	A"	77	77

Atom	x (Å)	y (Å)	z (Å)
C1	1.496	0.896	0.000
C2	0.000	0.682	0.000
O3	-0.211	-0.765	0.000
O4	-1.491	-1.046	0.000
H5	1.715	1.966	0.000
H6	1.949	0.449	0.887
H7	1.949	0.449	-0.887
H8	-0.487	1.082	-0.892
H9	-0.487	1.082	0.892

	C1	C2	O3	O4	H5	H6	H7	H8	H9
C1		1.5111	2.3817	3.5624	1.0929	1.0919	1.0919	2.1821	2.1821
C2	1.5111		1.4625	2.2823	2.1430	2.1540	2.1540	1.0921	1.0921
O3	2.3817	1.4625		1.3102	3.3426	2.6318	2.6318	2.0701	2.0701
O4	3.5624	2.2823	1.3102		4.3994	3.8539	3.8539	2.5168	2.5168
H5	1.0929	2.1430	3.3426	4.3994		1.7734	1.7734	2.5350	2.5350
H6	1.0919	2.1540	2.6318	3.8539	1.7734		1.7746	3.0820	2.5167
H7	1.0919	2.1540	2.6318	3.8539	1.7734	1.7746		2.5167	3.0820
H8	2.1821	1.0921	2.0701	2.5168	2.5350	3.0820	2.5167		1.7834
H9	2.1821	1.0921	2.0701	2.5168	2.5350	2.5167	3.0820	1.7834

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.430	C1	C2	H8	112.919
C1	C2	H9	112.919	C2	C1	H5	109.716
C2	C1	H6	110.654	C2	C1	H7	110.654
C2	O3	O4	110.679	O3	C2	H8	107.374
O3	C2	H9	107.374	H5	C1	H6	108.522
H5	C1	H7	108.522	H6	C1	H7	108.716
H8	C2	H9	109.481

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

using model chemistry: ROMP2/6-31G*

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 C2H5OO (ethylperoxy radical)

using model chemistry: ROMP2/6-31G*

States and conformations

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