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	hartrees
Energy at 0K	-598.643962
Energy at 298.15K
HF Energy	-598.643962
Nuclear repulsion energy	91.748994

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A	3090	3073	8.31	107.22	0.29	0.44
2	A	1251	1244	35.64	4.16	0.75	0.86
3	A	1079	1073	227.87	3.84	0.47	0.64
4	A	822	817	58.57	3.23	0.40	0.57
5	A	698	694	50.82	15.03	0.17	0.29
6	A	383	381	0.74	3.51	0.64	0.78

Atom	x (Å)	y (Å)	z (Å)
C1	0.549	0.562	-0.139
H2	0.735	1.508	0.382
F3	1.549	-0.346	0.028
Cl4	-1.057	-0.104	0.012

	C1	H2	F3	Cl4
C1		1.0953	1.3609	1.7458
H2	1.0953		2.0558	2.4383
F3	1.3609	2.0558		2.6177
Cl4	1.7458	2.4383	2.6177

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	113.201		H2	C1	Cl4	116.356
F3	C1	Cl4	114.262

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

using model chemistry: BLYP/6-31+G**

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	-0.040
2	H	0.173
3	F	-0.194
4	Cl	0.062

	x	y	z	Total
	-0.126	1.178	0.515	1.291
CHELPG
AIM
ESP

	x	y	z
x	5.287	0.529	-0.172
y	0.529	3.492	-0.030
z	-0.172	-0.030	2.803

<r²>	63.589
(<r²>)^1/2	7.974