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	hartrees
Energy at 0K	-1057.909755
Energy at 298.15K
HF Energy	-1057.662889
Nuclear repulsion energy	199.616032

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'	1223	1223	214.26	0.95	0.63	0.77
2	A'	608	608	12.40	15.51	0.07	0.13
3	A'	467	467	0.74	1.55	0.45	0.62
4	A'	282	282	0.02	3.56	0.56	0.72
5	A"	914	914	299.11	1.55	0.75	0.86
6	A"	383	383	0.18	2.38	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.158	0.443	0.000
F2	-0.703	1.438	0.000
Cl3	0.158	-0.459	1.473
Cl4	0.158	-0.459	-1.473

	C1	F2	Cl3	Cl4
C1		1.3156	1.7272	1.7272
F2	1.3156		2.5513	2.5513
Cl3	1.7272	2.5513		2.9453
Cl4	1.7272	2.5513	2.9453

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	Cl3	113.272		F2	C1	Cl4	113.272
Cl3	C1	Cl4	117.001

All results from a given calculation for CFCl₂ (dichlorofluoromethyl radical)

using model chemistry: B2PLYP=FULLultrafine/6-31G(2df,p)

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 CFCl2 (dichlorofluoromethyl radical)

using model chemistry: B2PLYP=FULLultrafine/6-31G(2df,p)

States and conformations

All results from a given calculation for CFCl₂ (dichlorofluoromethyl radical)