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	hartrees
Energy at 0K	-139.070650
Energy at 298.15K	-139.071931
HF Energy	-139.070650
Nuclear repulsion energy	32.239116

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3148	3004	15.33
2	A'	1493	1425	6.66
3	A'	1207	1152	118.82
4	A'	612	585	43.70
5	A"	3302	3152	21.27
6	A"	1194	1140	8.89

Atom	x (Å)	y (Å)	z (Å)
C1	0.029	0.653	0.000
F2	0.029	-0.681	0.000
H3	-0.217	1.102	0.954
H4	-0.217	1.102	-0.954

	C1	F2	H3	H4
C1		1.3341	1.0825	1.0825
F2	1.3341		2.0369	2.0369
H3	1.0825	2.0369		1.9078
H4	1.0825	2.0369	1.9078

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	114.495		F2	C1	H4	114.495
H3	C1	H4	123.585

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

using model chemistry: mPW1PW91/6-311G*

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	-0.221
2	F	-0.198
3	H	0.209
4	H	0.209

	x	y	z	Total
	-0.444	1.323	0.000	1.396
CHELPG
AIM
ESP

	x	y	z
x	1.256	-0.104	0.000
y	-0.104	1.916	0.000
z	0.000	0.000	1.776

<r²>	18.157
(<r²>)^1/2	4.261

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

using model chemistry: mPW1PW91/6-311G*

States and conformations

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