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	hartrees
Energy at 0K	-537.864278
Energy at 298.15K	-537.867934
HF Energy	-537.494718
Nuclear repulsion energy	94.405333

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3248	3248
2	A'	3168	3168
3	A'	1558	1558
4	A'	1527	1527
5	A'	1340	1340
6	A'	1128	1128
7	A'	708	708
8	A'	617	617
9	A'	319	319
10	A"	3364	3364
11	A"	3237	3237
12	A"	1315	1315
13	A"	1121	1121
14	A"	808	808
15	A"	211	211

Atom	x (Å)	y (Å)	z (Å)
C1	-1.474	0.809	0.000
C2	0.000	0.854	0.000
Cl3	0.710	-0.823	0.000
H4	-2.012	0.665	0.928
H5	-2.012	0.665	-0.928
H6	0.398	1.342	-0.890
H7	0.398	1.342	0.890

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4743	2.7260	1.0818	1.0818	2.1396	2.1396
C2	1.4743		1.8212	2.2232	2.2232	1.0897	1.0897
Cl3	2.7260	1.8212		3.2376	3.2376	2.3613	2.3613
H4	1.0818	2.2232	3.2376		1.8551	3.0927	2.5029
H5	1.0818	2.2232	3.2376	1.8551		2.5029	3.0927
H6	2.1396	1.0897	2.3613	3.0927	2.5029		1.7791
H7	2.1396	1.0897	2.3613	2.5029	3.0927	1.7791

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	111.187	C1	C2	H6	112.247
C1	C2	H7	112.247	C2	C1	H4	120.072
C2	C1	H5	120.072	Cl3	C2	H6	105.663
Cl3	C2	H7	105.663	H4	C1	H5	118.050

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

using model chemistry: ROMP2/6-31G*

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	-0.320
2	C	-0.392
3	Cl	-0.124
4	H	0.196
5	H	0.196
6	H	0.223
7	H	0.223

<r²>	73.732
(<r²>)^1/2	8.587

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

using model chemistry: ROMP2/6-31G*

States and conformations

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