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	hartrees
Energy at 0K	-78.953173
Energy at 298.15K	-78.957038
HF Energy	-78.626230
Nuclear repulsion energy	37.076320

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3233	2987	11.41
2	A'	3144	2905	19.94
3	A'	3070	2836	23.21
4	A'	1538	1421	3.51
5	A'	1521	1405	2.46
6	A'	1455	1345	0.85
7	A'	1093	1010	0.02
8	A'	1018	941	0.43
9	A'	465	430	55.42
10	A"	3339	3085	10.47
11	A"	3185	2943	19.00
12	A"	1539	1422	5.37
13	A"	1234	1140	1.84
14	A"	831	768	1.18
15	A"	132	122	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	-0.011	-0.695	0.000
C2	-0.011	0.794	0.000
H3	1.004	-1.096	0.000
H4	-0.509	-1.093	0.880
H5	-0.509	-1.093	-0.880
H6	0.074	1.344	-0.920
H7	0.074	1.344	0.920

	C1	C2	H3	H4	H5	H6	H7
C1		1.4888	1.0922	1.0861	1.0861	2.2387	2.2387
C2	1.4888		2.1459	2.1404	2.1404	1.0756	1.0756
H3	1.0922	2.1459		1.7504	1.7504	2.7691	2.7691
H4	1.0861	2.1404	1.7504		1.7593	3.0852	2.5061
H5	1.0861	2.1404	1.7504	1.7593		2.5061	3.0852
H6	2.2387	1.0756	2.7691	3.0852	2.5061		1.8406
H7	2.2387	1.0756	2.7691	2.5061	3.0852	1.8406

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.763	C1	C2	H7	120.763
C2	C1	H3	111.569	C2	C1	H4	111.493
C2	C1	H5	111.493	H3	C1	H4	106.937
H3	C1	H5	106.937	H4	C1	H5	108.169
H6	C2	H7	117.652

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

using model chemistry: CID/6-311+G(3df,2p)

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: CID/6-311+G(3df,2p)

States and conformations

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