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	hartrees
Energy at 0K	-14.085266
Energy at 298.15K	-14.089157
HF Energy	-13.842622
Nuclear repulsion energy	22.454118

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3196	3045	17.64
2	A'	3122	2974	27.56
3	A'	3032	2889	28.71
4	A'	1525	1453	4.42
5	A'	1511	1440	3.75
6	A'	1444	1375	1.37
7	A'	1078	1027	0.02
8	A'	1004	957	0.36
9	A'	459	437	71.19
10	A"	3313	3156	18.93
11	A"	3169	3019	24.69
12	A"	1535	1462	6.13
13	A"	1228	1170	1.57
14	A"	819	780	1.81
15	A"	162	154	0.43

Atom	x (Å)	y (Å)	z (Å)
C1	-0.015	-0.703	0.000
C2	-0.015	0.802	0.000
H3	1.009	-1.107	0.000
H4	-0.518	-1.098	0.888
H5	-0.518	-1.098	-0.888
H6	0.101	1.353	-0.927
H7	0.101	1.353	0.927

	C1	C2	H3	H4	H5	H6	H7
C1		1.5054	1.1009	1.0945	1.0945	2.2583	2.2583
C2	1.5054		2.1670	2.1572	2.1572	1.0845	1.0845
H3	1.1009	2.1670		1.7669	1.7669	2.7819	2.7819
H4	1.0945	2.1572	1.7669		1.7754	3.1120	2.5282
H5	1.0945	2.1572	1.7669	1.7754		2.5282	3.1120
H6	2.2583	1.0845	2.7819	3.1120	2.5282		1.8545
H7	2.2583	1.0845	2.7819	2.5282	3.1120	1.8545

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.507	C1	C2	H7	120.507
C2	C1	H3	111.555	C2	C1	H4	111.157
C2	C1	H5	111.157	H3	C1	H4	107.188
H3	C1	H5	107.188	H4	C1	H5	108.404
H6	C2	H7	117.519

All results from a given calculation for C₂H₅ (Ethyl radical)

using model chemistry: MP2/CEP-121G*

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 C2H5 (Ethyl radical)

using model chemistry: MP2/CEP-121G*

States and conformations

All results from a given calculation for C₂H₅ (Ethyl radical)