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	hartrees
Energy at 0K	-537.964425
Energy at 298.15K	-537.968103
HF Energy	-537.547290
Nuclear repulsion energy	94.353895

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3228	3228
2	A'	3157	3157
3	A'	1529	1529
4	A'	1495	1495
5	A'	1328	1328
6	A'	1115	1115
7	A'	707	707
8	A'	626	626
9	A'	314	314
10	A"	3348	3348
11	A"	3228	3228
12	A"	1296	1296
13	A"	1106	1106
14	A"	802	802
15	A"	217	217

Atom	x (Å)	y (Å)	z (Å)
C1	-1.467	0.815	0.000
C2	0.000	0.861	0.000
Cl3	0.707	-0.829	0.000
H4	-2.002	0.677	0.926
H5	-2.002	0.677	-0.926
H6	0.396	1.341	-0.889
H7	0.396	1.341	0.889

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4678	2.7253	1.0783	1.0783	2.1308	2.1308
C2	1.4678		1.8321	2.2134	2.2134	1.0853	1.0853
Cl3	2.7253	1.8321		3.2347	3.2347	2.3659	2.3659
H4	1.0783	2.2134	3.2347		1.8523	3.0802	2.4888
H5	1.0783	2.2134	3.2347	1.8523		2.4888	3.0802
H6	2.1308	1.0853	2.3659	3.0802	2.4888		1.7780
H7	2.1308	1.0853	2.3659	2.4888	3.0802	1.7780

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	110.868	C1	C2	H6	112.274
C1	C2	H7	112.274	C2	C1	H4	119.988
C2	C1	H5	119.988	Cl3	C2	H6	105.502
Cl3	C2	H7	105.502	H4	C1	H5	118.388

All results from a given calculation for CH₂CH₂Cl (2-chloroethyl radical)

using model chemistry: ROMP2/TZVP

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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Number	Element	Mulliken
1	C	-0.226
2	C	-0.002
3	Cl	-0.222
4	H	0.114
5	H	0.114
6	H	0.111
7	H	0.111

<r²>	73.855
(<r²>)^1/2	8.594

All results from a given calculation for CH2CH2Cl (2-chloroethyl radical)

using model chemistry: ROMP2/TZVP

States and conformations

All results from a given calculation for CH₂CH₂Cl (2-chloroethyl radical)