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	hartrees
Energy at 0K	-1045.854380
Energy at 298.15K
HF Energy	-1045.820942
Nuclear repulsion energy	190.468484

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'	1382	1382	133.51	1.50	0.75	0.86
2	A'	640	640	27.24	17.54	0.09	0.16
3	A'	450	450	5.33	2.28	0.54	0.70
4	A'	254	254	1.92	4.49	0.62	0.76
5	A"	945	945	221.31	4.86	0.75	0.86
6	A"	359	359	0.23	3.21	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.173	0.520	0.000
F2	-0.767	1.481	0.000
Cl3	0.173	-0.484	1.538
Cl4	0.173	-0.484	-1.538

	C1	F2	Cl3	Cl4
C1		1.3440	1.8368	1.8368
F2	1.3440		2.6663	2.6663
Cl3	1.8368	2.6663		3.0769
Cl4	1.8368	2.6663	3.0769

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	Cl3	112.998		F2	C1	Cl4	112.998
Cl3	C1	Cl4	113.771

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

using model chemistry: B2PLYP=FULLultrafine/STO-3G

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/STO-3G

States and conformations

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