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	hartrees
Energy at 0K	-138.977104
Energy at 298.15K	-138.978241
HF Energy	-138.977104
Nuclear repulsion energy	31.907119

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3066	3031	11.30
2	A'	1426	1410	3.77
3	A'	1151	1137	113.38
4	A'	431	426	66.27
5	A"	3224	3188	10.21
6	A"	1136	1123	5.50

Atom	x (Å)	y (Å)	z (Å)
C1	0.022	0.660	0.000
F2	0.022	-0.689	0.000
H3	-0.167	1.122	0.968
H4	-0.167	1.122	-0.968

	C1	F2	H3	H4
C1		1.3489	1.0891	1.0891
F2	1.3489		2.0623	2.0623
H3	1.0891	2.0623		1.9356
H4	1.0891	2.0623	1.9356

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	115.118		F2	C1	H4	115.118
H3	C1	H4	125.388

All results from a given calculation for CH₂F (fluoromethyl radical)

using model chemistry: PBEPBEultrafine/TZVP

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	-0.080
2	F	-0.160
3	H	0.120
4	H	0.120

	x	y	z	Total
	-0.374	1.267	0.000	1.321
CHELPG
AIM
ESP

	x	y	z
x	1.653	-0.068	0.000
y	-0.068	2.274	0.000
z	0.000	0.000	1.992

<r²>	18.621
(<r²>)^1/2	4.315

All results from a given calculation for CH2F (fluoromethyl radical)

using model chemistry: PBEPBEultrafine/TZVP

States and conformations

All results from a given calculation for CH₂F (fluoromethyl radical)