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	hartrees
Energy at 0K	-304.739421
Energy at 298.15K	-304.741574
HF Energy	-304.739421
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1363	1337	177.71
2	A₁	830	814	184.16
3	A₁	559	548	40.81
4	B₁	725	711	11.35
5	B₂	1866	1829	367.89
6	B₂	535	525	3.71

Atom	y (Å)	z (Å)
N1	0.000	-0.197
F2	0.000	1.304
O3	1.104	-0.647
O4	-1.104	-0.647

	N1	F2	O3	O4
N1		1.5006	1.1919	1.1919
F2	1.5006		2.2413	2.2413
O3	1.1919	2.2413		2.2073
O4	1.1919	2.2413	2.2073

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	N1	O3	112.187		F2	N1	O4	112.187
O3	N1	O4	135.626

All results from a given calculation for FNO₂ (Nitryl fluoride)

using model chemistry: B97D3/6-31G*

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	N	0.752
2	F	-0.232
3	O	-0.260
4	O	-0.260

	x	y	z	Total
	0.000	0.000	-0.440	0.440
CHELPG
AIM
ESP

<r²>	54.604
(<r²>)^1/2	7.389

All results from a given calculation for FNO2 (Nitryl fluoride)

using model chemistry: B97D3/6-31G*

States and conformations

All results from a given calculation for FNO₂ (Nitryl fluoride)