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	hartrees
Energy at 0K	-1070.111209
Energy at 298.15K	-1070.112098
HF Energy	-1070.111209
Nuclear repulsion energy	194.953074

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	1141	1128	116.23
2	A	529	523	20.20
3	A	277	274	12.03
4	A	107	106	0.23
5	B	527	521	83.34
6	B	354	350	91.70

Atom	x (Å)	y (Å)	z (Å)
O1	0.320	0.546	0.874
O2	-0.320	-0.546	0.874
Cl3	-0.320	1.845	-0.411
Cl4	0.320	-1.845	-0.411

	O1	O2	Cl3	Cl4
O1		1.2657	1.9363	2.7148
O2	1.2657		2.7148	1.9363
Cl3	1.9363	2.7148		3.7447
Cl4	2.7148	1.9363	3.7447

Number	Element	Mulliken
1	O	0.014
2	O	0.014
3	Cl	-0.014
4	Cl	-0.014

All results from a given calculation for ClOOCl (Dichlorine dioxide)

using model chemistry: PBEPBE/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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	x	y	z	Total
	0.000	0.000	0.438	0.438
CHELPG
AIM
ESP

	x	y	z
x	4.162	-1.608	0.000
y	-1.608	13.356	0.000
z	0.000	0.000	5.556

<r²>	165.889
(<r²>)^1/2	12.880