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	hartrees
Energy at 0K	-538.127090
Energy at 298.15K	-538.121779
HF Energy	-537.503374
Nuclear repulsion energy	94.620454

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3398	3202	13.75
2	A	3286	3096	18.79
3	A	3253	3065	24.45
4	A	3185	3001	22.61
5	A	1629	1535	2.19
6	A	1617	1523	6.78
7	A	1564	1473	3.45
8	A	1423	1341	51.08
9	A	1194	1125	0.89
10	A	1120	1056	16.18
11	A	1107	1043	3.88
12	A	770	725	36.96
13	A	514	484	24.76
14	A	353	333	1.90
15	A	182	172	0.42

Atom	x (Å)	y (Å)	z (Å)
C1	0.443	0.602	-0.083
C2	1.642	-0.266	0.011
Cl3	-1.109	-0.129	0.007
H4	0.458	1.644	0.208
H5	1.577	-1.100	-0.693
H6	2.537	0.317	-0.220
H7	1.764	-0.691	1.017

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4841	1.7170	1.0818	2.1342	2.1185	2.1512
C2	1.4841		2.7544	2.2562	1.0931	1.0926	1.0983
Cl3	1.7170	2.7544		2.3740	2.9399	3.6799	3.0963
H4	1.0818	2.2562	2.3740		3.0971	2.5038	2.7950
H5	2.1342	1.0931	2.9399	3.0971		1.7757	1.7674
H6	2.1185	1.0926	3.6799	2.5038	1.7757		1.7727
H7	2.1512	1.0983	3.0963	2.7950	1.7674	1.7727

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.985	C1	C2	H6	109.588
C1	C2	H7	111.589	C2	C1	Cl3	118.286
C2	C1	H4	122.065	H5	C2	H6	108.612
H5	C2	H7	107.844	H6	C2	H7	108.125

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

using model chemistry: G2

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: G2

States and conformations

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