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	hartrees
Energy at 0K	-633.529366
Energy at 298.15K	-633.530135
HF Energy	-633.529366
Nuclear repulsion energy	113.156444

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1008	906	69.72
2	A'	827	743	146.46
3	A'	365	328	19.02

Atom	x (Å)	y (Å)
F1	-1.186	-0.658
Cl2	0.000	0.449
O3	1.334	-0.213

	F1	Cl2	O3
F1		1.6218	2.5583
Cl2	1.6218		1.4887
O3	2.5583	1.4887

Number	Element	Mulliken
1	F	-0.398
2	Cl	1.027
3	O	-0.629

All results from a given calculation for FClO (chlorosyl fluoride)

using model chemistry: HF/6-31G*

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
	-1.542	2.236	0.000	2.716
CHELPG
AIM
ESP

	x	y	z
x	3.726	0.180	0.000
y	0.180	2.046	0.000
z	0.000	0.000	1.387

<r²>	48.775
(<r²>)^1/2	6.984