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	hartrees
Energy at 0K	-1069.180261
Energy at 298.15K	-1069.181398
HF Energy	-1068.474050
Nuclear repulsion energy	205.725060

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	836	836	15.86
2	A	603	603	16.92
3	A	333	333	0.42
4	A	123	123	0.32
5	B	645	645	27.37
6	B	442	442	5.55

Atom	x (Å)	y (Å)	z (Å)
O1	0.343	0.595	0.831
O2	-0.343	-0.595	0.831
Cl3	-0.343	1.687	-0.391
Cl4	0.343	-1.687	-0.391

	O1	O2	Cl3	Cl4
O1		1.3730	1.7766	2.5881
O2	1.3730		2.5881	1.7766
Cl3	1.7766	2.5881		3.4424
Cl4	2.5881	1.7766	3.4424

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

using model chemistry: CCSD=FULL/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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