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	hartrees
Energy at 0K	-5238.835385
Energy at 298.15K	-5238.841124
HF Energy	-5238.835385
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1779	1749	253.76
2	A₁	378	372	7.60
3	A₁	166	163	0.07
4	B₁	496	488	2.01
5	B₂	662	651	443.03
6	B₂	317	312	6.43

Atom	y (Å)	z (Å)
C1	0.000	0.825
O2	0.000	2.026
Br3	1.651	-0.302
Br4	-1.651	-0.302

	C1	O2	Br3	Br4
C1		1.2007	1.9996	1.9996
O2	1.2007		2.8544	2.8544
Br3	1.9996	2.8544		3.3028
Br4	1.9996	2.8544	3.3028

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Br3	124.324		O2	C1	Br4	124.324
Br3	C1	Br4	111.352

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

using model chemistry: B97D3/3-21G

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	-0.009
2	O	-0.311
3	Br	0.160
4	Br	0.160

	x	y	z	Total
	0.000	0.000	-1.026	1.026
CHELPG
AIM
ESP

<r²>	263.269
(<r²>)^1/2	16.226

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

using model chemistry: B97D3/3-21G

States and conformations

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