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	hartrees
Energy at 0K	-304.760193
Energy at 298.15K	-304.762301
HF Energy	-304.760193
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1352	1329	191.42
2	A₁	796	783	208.89
3	A₁	526	517	79.02
4	B₁	711	699	9.08
5	B₂	1875	1842	430.23
6	B₂	516	507	3.68

Atom	y (Å)	z (Å)
N1	0.000	-0.214
F2	0.000	1.322
O3	1.105	-0.650
O4	-1.105	-0.650

	N1	F2	O3	O4
N1		1.5363	1.1881	1.1881
F2	1.5363		2.2612	2.2612
O3	1.1881	2.2612		2.2102
O4	1.1881	2.2612	2.2102

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	N1	O3	111.549		F2	N1	O4	111.549
O3	N1	O4	136.902

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

using model chemistry: B97D3/6-31+G**

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	0.185
2	F	-0.198
3	O	0.007
4	O	0.007

	x	y	z	Total
	0.000	0.000	-0.988	0.988
CHELPG
AIM
ESP

<r²>	55.715
(<r²>)^1/2	7.464

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

using model chemistry: B97D3/6-31+G**

States and conformations

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