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	hartrees
Energy at 0K	-78.331334
Energy at 298.15K	-78.335221
HF Energy	-78.163272
Nuclear repulsion energy	36.687559

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3205	3039	12.53
2	A'	3117	2955	21.16
3	A'	3046	2887	17.76
4	A'	1589	1507	5.57
5	A'	1557	1476	0.61
6	A'	1500	1422	3.70
7	A'	1063	1008	0.94
8	A'	1027	974	0.11
9	A'	451	428	55.75
10	A"	3314	3141	15.95
11	A"	3155	2991	17.72
12	A"	1599	1516	4.67
13	A"	1268	1202	2.90
14	A"	865	820	3.34
15	A"	149	141	0.33

Atom	x (Å)	y (Å)	z (Å)
C1	-0.013	-0.706	0.000
C2	-0.013	0.805	0.000
H3	1.010	-1.112	0.000
H4	-0.521	-1.097	0.888
H5	-0.521	-1.097	-0.888
H6	0.094	1.354	-0.927
H7	0.094	1.354	0.927

	C1	C2	H3	H4	H5	H6	H7
C1		1.5108	1.1007	1.0951	1.0951	2.2613	2.2613
C2	1.5108		2.1729	2.1597	2.1597	1.0827	1.0827
H3	1.1007	2.1729		1.7698	1.7698	2.7892	2.7892
H4	1.0951	2.1597	1.7698		1.7753	3.1112	2.5274
H5	1.0951	2.1597	1.7698	1.7753		2.5274	3.1112
H6	2.2613	1.0827	2.7892	3.1112	2.5274		1.8542
H7	2.2613	1.0827	2.7892	2.5274	3.1112	1.8542

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.464	C1	C2	H7	120.464
C2	C1	H3	111.655	C2	C1	H4	110.941
C2	C1	H5	110.941	H3	C1	H4	107.414
H3	C1	H5	107.414	H4	C1	H5	108.305
H6	C2	H7	117.801

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

using model chemistry: MP2=FULL/3-21G*

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=FULL/3-21G*

States and conformations

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