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	hartrees
Energy at 0K	-537.937891
Energy at 298.15K	-537.941552
HF Energy	-537.508691
Nuclear repulsion energy	94.376808

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3265	3038	4.65
2	A'	3197	2975	14.38
3	A'	1553	1445	0.13
4	A'	1523	1417	2.84
5	A'	1345	1252	31.20
6	A'	1121	1043	9.03
7	A'	710	661	102.37
8	A'	620	577	7.08
9	A'	319	297	11.62
10	A"	3380	3145	5.32
11	A"	3264	3037	3.82
12	A"	1308	1217	0.01
13	A"	1119	1042	1.25
14	A"	805	749	0.82
15	A"	205	191	2.32

Atom	x (Å)	y (Å)	z (Å)
C1	-1.476	0.809	0.000
C2	0.000	0.855	0.000
Cl3	0.712	-0.824	0.000
H4	-2.011	0.666	0.925
H5	-2.011	0.666	-0.925
H6	0.392	1.342	-0.887
H7	0.392	1.342	0.887

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4771	2.7297	1.0783	1.0783	2.1356	2.1356
C2	1.4771		1.8232	2.2219	2.2219	1.0846	1.0846
Cl3	2.7297	1.8232		3.2388	3.2388	2.3614	2.3614
H4	1.0783	2.2219	3.2388		1.8508	3.0846	2.4966
H5	1.0783	2.2219	3.2388	1.8508		2.4966	3.0846
H6	2.1356	1.0846	2.3614	3.0846	2.4966		1.7731
H7	2.1356	1.0846	2.3614	2.4966	3.0846	1.7731

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	111.178	C1	C2	H6	112.045
C1	C2	H7	112.045	C2	C1	H4	119.997
C2	C1	H5	119.997	Cl3	C2	H6	105.780
Cl3	C2	H7	105.780	H4	C1	H5	118.227

All results from a given calculation for CH₂CH₂Cl (2-chloroethyl radical)

using model chemistry: MP3/6-31+G**

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 CH2CH2Cl (2-chloroethyl radical)

using model chemistry: MP3/6-31+G**

States and conformations

All results from a given calculation for CH₂CH₂Cl (2-chloroethyl radical)