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	hartrees
Energy at 0K	-174.740228
Energy at 298.15K
HF Energy	-174.740228
Nuclear repulsion energy	33.648849

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'	3968	3570	60.97	69.01	0.34	0.51
2	A'	1509	1358	46.15	6.33	0.74	0.85
3	A'	1068	961	18.55	32.30	0.32	0.49

Atom	x (Å)	y (Å)
O1	0.052	0.703
H2	-0.892	0.888
F3	0.052	-0.724

	O1	H2	F3
O1		0.9624	1.4270
H2	0.9624		1.8678
F3	1.4270	1.8678

Number	Element	Mulliken
1	O	-0.226
2	H	0.432
3	F	-0.206

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

using model chemistry: HF/LANL2DZ

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
	-2.287	1.337	0.000	2.649
CHELPG
AIM
ESP

	x	y	z
x	0.795	-0.207	0.000
y	-0.207	2.127	0.000
z	0.000	0.000	0.219

<r²>	16.633
(<r²>)^1/2	4.078