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	hartrees
Energy at 0K	-538.138134
Energy at 298.15K	-538.141793
HF Energy	-537.566876
Nuclear repulsion energy	95.020146

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3239	3075	2.84
2	A'	3156	2996	11.62
3	A'	1529	1451	0.35
4	A'	1500	1424	4.00
5	A'	1284	1219	15.89
6	A'	1121	1064	7.84
7	A'	704	668	87.52
8	A'	625	594	5.28
9	A'	311	295	10.93
10	A"	3338	3170	1.78
11	A"	3205	3043	1.83
12	A"	1289	1224	0.15
13	A"	1084	1030	0.86
14	A"	794	754	1.20
15	A"	211	200	1.45

Atom	x (Å)	y (Å)	z (Å)
C1	-1.462	0.795	0.000
C2	0.000	0.857	0.000
Cl3	0.704	-0.817	0.000
H4	-1.992	0.655	0.922
H5	-1.992	0.655	-0.922
H6	0.397	1.334	-0.884
H7	0.397	1.334	0.884

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4636	2.7004	1.0728	1.0728	2.1284	2.1284
C2	1.4636		1.8162	2.2043	2.2043	1.0805	1.0805
Cl3	2.7004	1.8162		3.2067	3.2067	2.3461	2.3461
H4	1.0728	2.2043	3.2067		1.8446	3.0713	2.4840
H5	1.0728	2.2043	3.2067	1.8446		2.4840	3.0713
H6	2.1284	1.0805	2.3461	3.0713	2.4840		1.7688
H7	2.1284	1.0805	2.3461	2.4840	3.0713	1.7688

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	110.383	C1	C2	H6	112.701
C1	C2	H7	112.701	C2	C1	H4	119.912
C2	C1	H5	119.912	Cl3	C2	H6	105.338
Cl3	C2	H7	105.338	H4	C1	H5	118.576

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

using model chemistry: MP2=FULL/cc-pVTZ

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/cc-pVTZ

States and conformations

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