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	hartrees
Energy at 0K	-538.118754
Energy at 298.15K	-538.122297
HF Energy	-537.570216
Nuclear repulsion energy	95.049611

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3278	3097	5.19
2	A	3166	2991	9.95
3	A	3125	2952	11.69
4	A	3050	2882	15.48
5	A	1507	1423	2.58
6	A	1491	1408	8.25
7	A	1430	1351	6.01
8	A	1329	1256	39.19
9	A	1138	1075	3.00
10	A	1058	999	16.24
11	A	1020	964	0.57
12	A	753	712	23.76
13	A	417	394	24.72
14	A	330	312	5.45
15	A	165	156	0.55

Atom	x (Å)	y (Å)	z (Å)
C1	0.444	0.604	-0.074
C2	1.644	-0.267	0.010
Cl3	-1.109	-0.129	0.006
H4	0.457	1.648	0.186
H5	1.580	-1.086	-0.704
H6	2.539	0.314	-0.204
H7	1.754	-0.707	1.005

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4853	1.7189	1.0756	2.1322	2.1191	2.1444
C2	1.4853		2.7562	2.2597	1.0887	1.0880	1.0935
Cl3	1.7189	2.7562		2.3752	2.9413	3.6805	3.0864
H4	1.0756	2.2597	2.3752		3.0870	2.5033	2.8102
H5	2.1322	1.0887	2.9413	3.0870		1.7692	1.7593
H6	2.1191	1.0880	3.6805	2.5033	1.7692		1.7657
H7	2.1444	1.0935	3.0864	2.8102	1.7593	1.7657

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.921	C1	C2	H6	109.915
C1	C2	H7	111.620	C2	C1	Cl3	118.490
C2	C1	H4	123.066	H5	C2	H6	108.741
H5	C2	H7	107.460	H6	C2	H7	108.078

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

using model chemistry: MP3/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 CHClCH3 (1-chloroethyl radical)

using model chemistry: MP3/cc-pVTZ

States and conformations

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