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	hartrees
Energy at 0K	-6109.424672
Energy at 298.15K	-6109.430298
HF Energy	-6109.424672
Nuclear repulsion energy	833.686161

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	643	634	203.86
2	A₁	361	356	0.03
3	A₁	230	227	2.01
4	A₁	147	145	0.07
5	A₂	171	169	0.00
6	B₁	592	583	189.89
7	B₁	218	215	3.06
8	B₂	673	664	209.24
9	B₂	257	253	0.91

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.417
Cl2	0.000	1.463	1.442
Cl3	0.000	-1.463	1.442
Br4	1.617	0.000	-0.736
Br5	-1.617	0.000	-0.736

	C1	Cl2	Cl3	Br4	Br5
C1		1.7863	1.7863	1.9860	1.9860
Cl2	1.7863		2.9263	3.0819	3.0819
Cl3	1.7863	2.9263		3.0819	3.0819
Br4	1.9860	3.0819	3.0819		3.2344
Br5	1.9860	3.0819	3.0819	3.2344

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	Cl3	109.988	Cl2	C1	Br4	109.451
Cl2	C1	Br5	109.451	Cl3	C1	Br4	109.451
Cl3	C1	Br5	109.451	Br4	C1	Br5	109.033

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)

using model chemistry: B97D3/6-311G**

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	-0.427
2	Cl	0.097
3	Cl	0.097
4	Br	0.116
5	Br	0.116

	x	y	z	Total
	0.000	0.000	-0.124	0.124
CHELPG
AIM
ESP

<r²>	406.756
(<r²>)^1/2	20.168

All results from a given calculation for CBr2Cl2 (dibromodichloromethane)

using model chemistry: B97D3/6-311G**

States and conformations

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)