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	hartrees
Energy at 0K	-92.882699
Energy at 298.15K	-92.886317
HF Energy	-92.694297
Nuclear repulsion energy	56.104752

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3245	3125	20.41
2	A	3140	3025	17.56
3	A	3101	2987	24.30
4	A	3005	2895	19.37
5	A	1531	1474	6.11
6	A	1510	1454	12.20
7	A	1465	1411	9.43
8	A	1324	1275	41.97
9	A	1130	1088	3.83
10	A	1063	1024	6.66
11	A	1049	1010	17.91
12	A	674	649	28.69
13	A	528	509	36.75
14	A	326	314	2.36
15	A	190	183	0.22

Atom	x (Å)	y (Å)	z (Å)
C1	0.497	0.635	-0.100
C2	1.697	-0.286	0.014
Cl3	-1.159	-0.129	0.008
H4	0.504	1.665	0.259
H5	1.613	-1.131	-0.691
H6	2.615	0.281	-0.219
H7	1.800	-0.707	1.035

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.5172	1.8268	1.0915	2.1704	2.1504	2.1872
C2	1.5172		2.8606	2.3010	1.1032	1.1039	1.1085
Cl3	1.8268	2.8606		2.4593	3.0286	3.8029	3.1851
H4	1.0915	2.3010	2.4593		3.1545	2.5695	2.8124
H5	2.1704	1.1032	3.0286	3.1545		1.7946	1.7867
H6	2.1504	1.1039	3.8029	2.5695	1.7946		1.7924
H7	2.1872	1.1085	3.1851	2.8124	1.7867	1.7924

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.850	C1	C2	H6	109.240
C1	C2	H7	111.872	C2	C1	Cl3	117.320
C2	C1	H4	122.951	H5	C2	H6	108.797
H5	C2	H7	107.774	H6	C2	H7	108.222

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

using model chemistry: MP2/LANL2DZ

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/LANL2DZ

States and conformations

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