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	hartrees
Energy at 0K	-228.570539
Energy at 298.15K
HF Energy	-228.570539
Nuclear repulsion energy	66.265280

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	1929	1737	235.46	18.58	0.33	0.49
2	A'	878	790	297.93	14.14	0.41	0.58
3	A'	645	581	78.24	15.20	0.46	0.63

Atom	x (Å)	y (Å)
F1	-0.958	-0.549
N2	0.000	0.551
O3	1.077	0.136

	F1	N2	O3
F1		1.4587	2.1476
N2	1.4587		1.1545
O3	2.1476	1.1545

Number	Element	Mulliken
1	F	-0.341
2	N	0.446
3	O	-0.106

All results from a given calculation for FNO (Nitrosyl fluoride)

using model chemistry: HF/SDD

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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	0.824	1.081	0.000	1.359
CHELPG
AIM
ESP

	x	y	z
x	2.795	0.460	0.000
y	0.460	1.446	0.000
z	0.000	0.000	0.742

<r²>	32.689
(<r²>)^1/2	5.717