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	hartrees
Energy at 0K	-175.381965
Energy at 298.15K
HF Energy	-175.381965
Nuclear repulsion energy	33.046858

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'	3612	3571	33.57	55.77	0.25	0.40
2	A'	1344	1328	54.53	4.64	0.62	0.76
3	A'	933	922	7.09	10.59	0.26	0.41

Atom	x (Å)	y (Å)
O1	0.054	0.720
H2	-0.922	0.852
F3	0.054	-0.735

	O1	H2	F3
O1		0.9849	1.4547
H2	0.9849		1.8627
F3	1.4547	1.8627

Number	Element	Mulliken
1	O	-0.275
2	H	0.367
3	F	-0.091

All results from a given calculation for HOF (Hypofluorous acid)

using model chemistry: PBEPBEultrafine/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
	-1.840	0.929	0.000	2.061
CHELPG
AIM
ESP

	x	y	z
x	1.270	-0.122	0.000
y	-0.122	2.049	0.000
z	0.000	0.000	1.085

<r²>	17.126
(<r²>)^1/2	4.138