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	hartrees
Energy at 0K	-598.565248
Energy at 298.15K
HF Energy	-598.565248
Nuclear repulsion energy	93.258270

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3189	3056	14.77
2	A	1323	1268	79.81
3	A	1214	1164	159.34
4	A	862	826	63.09
5	A	735	705	36.48
6	A	406	390	1.24

Atom	x (Å)	y (Å)	z (Å)
C1	0.546	0.547	-0.132
H2	0.719	1.503	0.357
F3	1.524	-0.340	0.027
Cl4	-1.042	-0.101	0.011

	C1	H2	F3	Cl4
C1		1.0878	1.3296	1.7215
H2	1.0878		2.0386	2.4069
F3	1.3296	2.0386		2.5768
Cl4	1.7215	2.4069	2.5768

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	114.606		H2	C1	Cl4	116.075
F3	C1	Cl4	114.638

All results from a given calculation for CHFCl (Chlorofluoromethyl radical)

using model chemistry: B3PW91/6-31G**

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	0.047
2	H	0.165
3	F	-0.218
4	Cl	0.006

	x	y	z	Total
	0.216	1.124	0.423	1.221
CHELPG
AIM
ESP

	x	y	z
x	4.248	0.546	-0.083
y	0.546	2.711	0.095
z	-0.083	0.095	1.851

<r²>	61.496
(<r²>)^1/2	7.842