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	hartrees
Energy at 0K	-5261.648180
Energy at 298.15K	-5261.654030
HF Energy	-5261.648180
Nuclear repulsion energy	442.395482

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1906	1842	373.23
2	A₁	412	398	7.28
3	A₁	175	169	0.36
4	B₁	513	496	3.10
5	B₂	720	695	517.16
6	B₂	340	328	9.10

Atom	y (Å)	z (Å)
C1	0.000	0.788
O2	0.000	1.957
Br3	1.623	-0.291
Br4	-1.623	-0.291

	C1	O2	Br3	Br4
C1		1.1686	1.9489	1.9489
O2	1.1686		2.7725	2.7725
Br3	1.9489	2.7725		3.2455
Br4	1.9489	2.7725	3.2455

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Br3	123.629		O2	C1	Br4	123.629
Br3	C1	Br4	112.742

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

using model chemistry: B3LYP/6-311G*

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	0.073
2	O	-0.170
3	Br	0.049
4	Br	0.049

	x	y	z	Total
	0.000	0.000	-1.080	1.080
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B3LYP/6-311G*

States and conformations

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