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	hartrees
Energy at 0K	-634.971687
Energy at 298.15K	-634.972478
HF Energy	-634.971687
Nuclear repulsion energy	102.498387

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	997	950	52.95
2	A'	780	743	5.76
3	A'	399	380	1.08

Atom	x (Å)	y (Å)
Cl1	-0.735	-0.694
O2	0.000	0.819
F3	1.388	0.583

	Cl1	O2	F3
Cl1		1.6827	2.4778
O2	1.6827		1.4084
F3	2.4778	1.4084

Number	Element	Mulliken
1	Cl	0.191
2	O	-0.096
3	F	-0.095

All results from a given calculation for ClOF (Chlorine hypofluorite)

using model chemistry: M06-2X/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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	-0.840	-0.826	0.000	1.178
CHELPG
AIM
ESP

	x	y	z
x	3.682	0.946	0.000
y	0.946	3.297	0.000
z	0.000	0.000	1.956

<r²>	57.098
(<r²>)^1/2	7.556