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	hartrees
Energy at 0K	-537.994016
Energy at 298.15K	-537.997618
HF Energy	-537.518569
Nuclear repulsion energy	95.183064

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3293	3110	4.22
2	A	3209	3031	4.39
3	A	3166	2990	6.43
4	A	3078	2907	9.18
5	A	1513	1430	2.67
6	A	1497	1414	8.26
7	A	1429	1349	6.43
8	A	1326	1253	39.67
9	A	1142	1078	4.17
10	A	1057	999	20.70
11	A	1019	963	0.68
12	A	764	721	24.17
13	A	463	437	26.14
14	A	337	319	2.74
15	A	175	165	0.30

Atom	x (Å)	y (Å)	z (Å)
C1	0.441	0.607	-0.085
C2	1.638	-0.267	0.011
Cl3	-1.105	-0.129	0.007
H4	0.452	1.644	0.214
H5	1.565	-1.105	-0.683
H6	2.536	0.306	-0.223
H7	1.756	-0.684	1.018

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4850	1.7152	1.0798	2.1335	2.1207	2.1476
C2	1.4850		2.7466	2.2587	1.0910	1.0907	1.0962
Cl3	1.7152	2.7466		2.3691	2.9252	3.6742	3.0849
H4	1.0798	2.2587	2.3691		3.0992	2.5153	2.7872
H5	2.1335	1.0910	2.9252	3.0992		1.7739	1.7630
H6	2.1207	1.0907	3.6742	2.5153	1.7739		1.7690
H7	2.1476	1.0962	3.0849	2.7872	1.7630	1.7690

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.907	C1	C2	H6	109.895
C1	C2	H7	111.727	C2	C1	Cl3	118.062
C2	C1	H4	122.660	H5	C2	H6	108.800
H5	C2	H7	107.430	H6	C2	H7	107.973

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

using model chemistry: MP2/6-31G(2df,p)

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: MP2/6-31G(2df,p)

States and conformations

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