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	hartrees
Energy at 0K	-538.019042
Energy at 298.15K	-538.022661
HF Energy	-537.541795
Nuclear repulsion energy	95.070360

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3269	3096	9.33
2	A	3183	3015	8.98
3	A	3138	2972	12.41
4	A	3052	2891	15.65
5	A	1527	1446	4.33
6	A	1509	1429	12.21
7	A	1454	1377	11.88
8	A	1356	1284	36.63
9	A	1153	1092	3.26
10	A	1076	1019	24.34
11	A	1037	982	0.61
12	A	767	727	26.89
13	A	455	431	34.11
14	A	338	321	4.60
15	A	184	174	0.53

Atom	x (Å)	y (Å)	z (Å)
C1	0.443	0.605	-0.083
C2	1.641	-0.266	0.011
Cl3	-1.107	-0.129	0.007
H4	0.454	1.646	0.209
H5	1.581	-1.091	-0.703
H6	2.541	0.314	-0.200
H7	1.747	-0.706	1.011

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4846	1.7174	1.0811	2.1346	2.1216	2.1487
C2	1.4846		2.7517	2.2597	1.0922	1.0915	1.0975
Cl3	1.7174	2.7517		2.3723	2.9424	3.6809	3.0803
H4	1.0811	2.2597	2.3723		3.0972	2.5098	2.8016
H5	2.1346	1.0922	2.9424	3.0972		1.7739	1.7644
H6	2.1216	1.0915	3.6809	2.5098	1.7739		1.7714
H7	2.1487	1.0975	3.0803	2.8016	1.7644	1.7714

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.953	C1	C2	H6	109.949
C1	C2	H7	111.768	C2	C1	Cl3	118.310
C2	C1	H4	122.684	H5	C2	H6	108.646
H5	C2	H7	107.370	H6	C2	H7	108.039

All results from a given calculation for CHClCH₃ (1-chloroethyl radical)

using model chemistry: MP2=FULL/6-311G*

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 CHClCH3 (1-chloroethyl radical)

using model chemistry: MP2=FULL/6-311G*

States and conformations

All results from a given calculation for CHClCH₃ (1-chloroethyl radical)