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	hartrees
Energy at 0K	-228.869621
Energy at 298.15K	-228.875568
HF Energy	-228.243793
Nuclear repulsion energy	124.248185

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3244	3244
2	A'	3162	3162
3	A'	3146	3146
4	A'	1567	1567
5	A'	1555	1555
6	A'	1471	1471
7	A'	1421	1421
8	A'	1221	1221
9	A'	1176	1176
10	A'	1071	1071
11	A'	881	881
12	A'	521	521
13	A'	311	311
14	A"	3256	3256
15	A"	3230	3230
16	A"	1544	1544
17	A"	1310	1310
18	A"	1188	1188
19	A"	822	822
20	A"	221	221
21	A"	59	59

Atom	x (Å)	y (Å)	z (Å)
C1	1.493	0.899	0.000
C2	0.000	0.679	0.000
O3	-0.209	-0.766	0.000
O4	-1.489	-1.048	0.000
H5	1.705	1.967	0.000
H6	1.945	0.456	0.884
H7	1.945	0.456	-0.884
H8	-0.485	1.079	-0.888
H9	-0.485	1.079	0.888

	C1	C2	O3	O4	H5	H6	H7	H8	H9
C1		1.5091	2.3814	3.5614	1.0885	1.0875	1.0875	2.1761	2.1761
C2	1.5091		1.4603	2.2803	2.1370	2.1485	2.1485	1.0883	1.0883
O3	2.3814	1.4603		1.3103	3.3369	2.6301	2.6301	2.0664	2.0664
O4	3.5614	2.2803	1.3103		4.3924	3.8520	3.8520	2.5141	2.5141
H5	1.0885	2.1370	3.3369	4.3924		1.7669	1.7669	2.5252	2.5252
H6	1.0875	2.1485	2.6301	3.8520	1.7669		1.7681	3.0722	2.5095
H7	1.0875	2.1485	2.6301	3.8520	1.7669	1.7681		2.5095	3.0722
H8	2.1761	1.0883	2.0664	2.5141	2.5252	3.0722	2.5095		1.7763
H9	2.1761	1.0883	2.0664	2.5141	2.5252	2.5095	3.0722	1.7763

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.624	C1	C2	H8	112.811
C1	C2	H9	112.811	C2	C1	H5	109.640
C2	C1	H6	110.616	C2	C1	H7	110.616
C2	O3	O4	110.667	O3	C2	H8	107.448
O3	C2	H9	107.448	H5	C1	H6	108.576
H5	C1	H7	108.576	H6	C1	H7	108.763
H8	C2	H9	109.383

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)