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	hartrees
Energy at 0K	-538.004693
Energy at 298.15K	-538.008278
HF Energy	-537.548216
Nuclear repulsion energy	94.633866

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3238	3089	10.12
2	A	3138	2994	14.07
3	A	3096	2954	17.80
4	A	3019	2881	20.91
5	A	1504	1435	2.27
6	A	1488	1420	7.34
7	A	1437	1371	4.72
8	A	1339	1277	39.68
9	A	1136	1083	2.98
10	A	1062	1013	17.33
11	A	1025	978	0.51
12	A	755	720	25.44
13	A	439	419	27.35
14	A	331	316	4.26
15	A	179	171	0.46

Atom	x (Å)	y (Å)	z (Å)
C1	0.444	0.608	-0.081
C2	1.650	-0.268	0.011
Cl3	-1.113	-0.130	0.007
H4	0.457	1.653	0.205
H5	1.587	-1.095	-0.706
H6	2.550	0.317	-0.204
H7	1.756	-0.708	1.015

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4934	1.7251	1.0833	2.1439	2.1298	2.1572
C2	1.4934		2.7661	2.2698	1.0958	1.0951	1.1009
Cl3	1.7251	2.7661		2.3832	2.9546	3.6963	3.0951
H4	1.0833	2.2698	2.3832		3.1075	2.5171	2.8134
H5	2.1439	1.0958	2.9546	3.1075		1.7810	1.7718
H6	2.1298	1.0951	3.6963	2.5171	1.7810		1.7791
H7	2.1572	1.1009	3.0951	2.8134	1.7718	1.7791

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.857	C1	C2	H6	109.773
C1	C2	H7	111.616	C2	C1	Cl3	118.326
C2	C1	H4	122.698	H5	C2	H6	108.758
H5	C2	H7	107.526	H6	C2	H7	108.215

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

using model chemistry: QCISD/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: QCISD/6-311G**

States and conformations

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