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	hartrees
Energy at 0K	-304.756330
Energy at 298.15K	-304.758072
HF Energy	-304.756330
Nuclear repulsion energy	120.003123

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1825	1748	166.84
2	A'	1002	959	17.18
3	A'	868	832	58.91
4	A'	558	534	100.55
5	A'	311	298	0.20
6	A"	433	415	0.12

Atom	x (Å)	y (Å)
F1	1.287	0.337
O2	0.000	0.891
N3	-0.974	-0.092
O4	-0.595	-1.189

	F1	O2	N3	O4
F1		1.4012	2.3010	2.4230
O2	1.4012		1.3841	2.1640
N3	2.3010	1.3841		1.1604
O4	2.4230	2.1640	1.1604

Number	Element	Mulliken
1	F	-0.148
2	O	-0.011
3	N	0.316
4	O	-0.158

All results from a given calculation for FONO (Nitrosyl hypofluorite)

using model chemistry: B1B95/6-31G(2df,p)

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
	-0.327	0.160	0.000	0.364
CHELPG
AIM
ESP

	x	y	z
x	3.384	0.519	0.000
y	0.519	3.254	0.000
z	0.000	0.000	1.643

<r²>	55.754
(<r²>)^1/2	7.467