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	hartrees
Energy at 0K	-5250.904883
Energy at 298.15K	-5250.910857
HF Energy	-5250.904883
Nuclear repulsion energy	458.015450

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1881	1851	263.65
2	A₁	460	453	4.56
3	A₁	190	187	0.24
4	B₁	534	526	1.02
5	B₂	784	771	410.32
6	B₂	354	348	0.28

Atom	y (Å)	z (Å)
C1	0.000	0.762
O2	0.000	1.941
Br3	1.553	-0.287
Br4	-1.553	-0.287

	C1	O2	Br3	Br4
C1		1.1795	1.8737	1.8737
O2	1.1795		2.7159	2.7159
Br3	1.8737	2.7159		3.1053
Br4	1.8737	2.7159	3.1053

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Br3	124.041		O2	C1	Br4	124.041
Br3	C1	Br4	111.917

All results from a given calculation for COBr₂ (Carbonic dibromide)

using model chemistry: LSDA/6-31G(2df,p)

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	C	-0.041
2	O	-0.119
3	Br	0.080
4	Br	0.080

	x	y	z	Total
	0.000	0.000	-1.155	1.155
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for COBr2 (Carbonic dibromide)

using model chemistry: LSDA/6-31G(2df,p)

States and conformations

All results from a given calculation for COBr₂ (Carbonic dibromide)