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	hartrees
Energy at 0K	-78.908673
Energy at 298.15K	-78.912529
HF Energy	-78.603842
Nuclear repulsion energy	36.655000

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3209	3018	12.26
2	A'	3132	2945	23.26
3	A'	3051	2869	24.80
4	A'	1497	1407	1.26
5	A'	1480	1392	3.98
6	A'	1410	1326	0.25
7	A'	1092	1027	0.05
8	A'	991	932	0.21
9	A'	443	416	44.08
10	A"	3319	3120	12.31
11	A"	3176	2987	19.39
12	A"	1491	1402	4.03
13	A"	1204	1132	2.01
14	A"	811	763	1.40
15	A"	150	141	0.15

Atom	x (Å)	y (Å)	z (Å)
C1	-0.014	-0.700	0.000
C2	-0.014	0.800	0.000
H3	1.016	-1.109	0.000
H4	-0.519	-1.103	0.893
H5	-0.519	-1.103	-0.893
H6	0.094	1.356	-0.935
H7	0.094	1.356	0.935

	C1	C2	H3	H4	H5	H6	H7
C1		1.4998	1.1085	1.1025	1.1025	2.2612	2.2612
C2	1.4998		2.1696	2.1622	2.1622	1.0930	1.0930
H3	1.1085	2.1696		1.7762	1.7762	2.7935	2.7935
H4	1.1025	2.1622	1.7762		1.7854	3.1250	2.5354
H5	1.1025	2.1622	1.7762	1.7854		2.5354	3.1250
H6	2.2612	1.0930	2.7935	3.1250	2.5354		1.8693
H7	2.2612	1.0930	2.7935	2.5354	3.1250	1.8693

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.596	C1	C2	H7	120.596
C2	C1	H3	111.694	C2	C1	H4	111.470
C2	C1	H5	111.470	H3	C1	H4	106.908
H3	C1	H5	106.908	H4	C1	H5	108.144
H6	C2	H7	117.534

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

using model chemistry: MP3=FULL/cc-pVDZ

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: MP3=FULL/cc-pVDZ

States and conformations

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