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	hartrees
Energy at 0K	-174.822572
Energy at 298.15K
HF Energy	-174.822572
Nuclear repulsion energy	35.101195

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'	4106	3730	79.40	42.29	0.24	0.38
2	A'	1597	1451	55.55	2.26	0.57	0.73
3	A'	1181	1072	20.00	21.43	0.30	0.46

Atom	x (Å)	y (Å)
O1	0.052	0.671
H2	-0.876	0.848
F3	0.052	-0.691

	O1	H2	F3
O1		0.9447	1.3622
H2	0.9447		1.7971
F3	1.3622	1.7971

Number	Element	Mulliken
1	O	-0.121
2	H	0.278
3	F	-0.157

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

using model chemistry: HF/cc-pVQZ

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
	-1.780	1.001	0.000	2.043
CHELPG
AIM
ESP

	x	y	z
x	1.151	-0.142	0.000
y	-0.142	1.972	0.000
z	0.000	0.000	0.885

<r²>	15.648
(<r²>)^1/2	3.956