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	hartrees
Energy at 0K	-379.817763
Energy at 298.15K	-379.820289
Nuclear repulsion energy	180.669837

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1806	1794	333.51
2	A'	1315	1306	204.46
3	A'	950	943	69.21
4	A'	782	777	106.07
5	A'	615	611	3.68
6	A'	409	406	21.45
7	A'	265	263	1.44
8	A"	685	681	8.20
9	A"	173	172	0.06

Atom	x (Å)	y (Å)
N1	0.000	0.647
O2	-0.694	-0.745
O3	1.189	0.647
O4	-0.863	1.477
F5	0.327	-1.729

	N1	O2	O3	O4	F5
N1		1.5562	1.1889	1.1971	2.3985
O2	1.5562		2.3418	2.2288	1.4180
O3	1.1889	2.3418		2.2135	2.5267
O4	1.1971	2.2288	2.2135		3.4196
F5	2.3985	1.4180	2.5267	3.4196

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	F5	107.405		O2	N1	O3	116.461
O2	N1	O4	107.380		O3	N1	O4	136.160

All results from a given calculation for FNO₃ (Fluorine nitrate)

using model chemistry: PBEPBE/cc-pVTZ

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	0.414
2	O	-0.045
3	O	-0.136
4	O	-0.159
5	F	-0.074

	x	y	z	Total
	0.026	0.289	0.000	0.291
CHELPG
AIM
ESP

	x	y	z
x	4.350	-0.502	0.000
y	-0.502	5.408	0.000
z	0.000	0.000	1.746

<r²>	93.615
(<r²>)^1/2	9.675

All results from a given calculation for FNO3 (Fluorine nitrate)

using model chemistry: PBEPBE/cc-pVTZ

States and conformations

All results from a given calculation for FNO₃ (Fluorine nitrate)