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	hartrees
Energy at 0K	-707.927074
Energy at 298.15K	-707.928650
HF Energy	-707.927074
Nuclear repulsion energy	186.973487

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1044	1036	57.22
2	A'	640	635	129.62
3	A'	490	486	28.51
4	A'	346	343	2.19
5	A"	1175	1166	168.13
6	A"	291	289	6.15

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.343	0.152	0.000
F2	-1.256	0.870	0.000
O3	0.343	-0.651	1.246
O4	0.343	-0.651	-1.246

	Cl1	F2	O3	O4
Cl1		1.7524	1.4822	1.4822
F2	1.7524		2.5340	2.5340
O3	1.4822	2.5340		2.4915
O4	1.4822	2.5340	2.4915

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Cl1	O3	102.825		F2	Cl1	O4	102.825
O3	Cl1	O4	114.380

All results from a given calculation for ClO₂F (Chloryl fluoride)

using model chemistry: SVWN/cc-pVDZ

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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Number	Element	Mulliken
1	Cl	0.897
2	F	-0.294
3	O	-0.302
4	O	-0.302

	x	y	z	Total
	1.607	1.017	0.000	1.902
CHELPG
AIM
ESP

	x	y	z
x	2.806	-0.909	0.000
y	-0.909	2.687	0.000
z	0.000	0.000	4.107

<r²>	74.570
(<r²>)^1/2	8.635

All results from a given calculation for ClO2F (Chloryl fluoride)

using model chemistry: SVWN/cc-pVDZ

States and conformations

All results from a given calculation for ClO₂F (Chloryl fluoride)