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	hartrees
Energy at 0K	-537.922982
Energy at 298.15K	-537.926654
HF Energy	-537.508638
Nuclear repulsion energy	94.621549

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3268	3069	4.32
2	A'	3186	2993	13.61
3	A'	1550	1456	0.02
4	A'	1520	1428	3.65
5	A'	1340	1259	29.10
6	A'	1126	1058	8.64
7	A'	714	670	104.34
8	A'	628	589	7.09
9	A'	318	299	12.22
10	A"	3390	3184	3.59
11	A"	3261	3063	2.86
12	A"	1307	1228	0.00
13	A"	1120	1052	1.25
14	A"	806	757	1.11
15	A"	209	196	2.35

Atom	x (Å)	y (Å)	z (Å)
C1	-1.471	0.805	0.000
C2	0.000	0.853	0.000
Cl3	0.709	-0.821	0.000
H4	-2.005	0.660	0.924
H5	-2.005	0.660	-0.924
H6	0.392	1.341	-0.887
H7	0.392	1.341	0.887

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4722	2.7200	1.0774	1.0774	2.1321	2.1321
C2	1.4722		1.8181	2.2166	2.2166	1.0849	1.0849
Cl3	2.7200	1.8181		3.2271	3.2271	2.3574	2.3574
H4	1.0774	2.2166	3.2271		1.8489	3.0809	2.4927
H5	1.0774	2.2166	3.2271	1.8489		2.4927	3.0809
H6	2.1321	1.0849	2.3574	3.0809	2.4927		1.7730
H7	2.1321	1.0849	2.3574	2.4927	3.0809	1.7730

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	111.080	C1	C2	H6	112.093
C1	C2	H7	112.093	C2	C1	H4	119.979
C2	C1	H5	119.979	Cl3	C2	H6	105.805
Cl3	C2	H7	105.805	H4	C1	H5	118.189

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

using model chemistry: MP2=FULL/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: MP2=FULL/6-31+G**

States and conformations

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