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	hartrees
Energy at 0K	-192.409575
Energy at 298.15K	-192.408860
HF Energy	-192.409575
Nuclear repulsion energy	55.334035

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2112	2099	2.43
2	Σ	891	886	125.22
3	Π	239	238	1.08
3	Π	239	238	1.08

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.404
N2	0.000	0.000	-0.217
F3	0.000	0.000	1.105

	C1	N2	F3
C1		1.1877	2.5090
N2	1.1877		1.3213
F3	2.5090	1.3213

Number	Element	Mulliken
1	C	-0.177
2	N	0.326
3	F	-0.149

All results from a given calculation for CNF (iso cyanogen fluoride)

using model chemistry: PBEPBE/aug-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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<r²>	33.637
(<r²>)^1/2	5.800