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	hartrees
Energy at 0K	-6107.534263
Energy at 298.15K	-6107.540138
HF Energy	-6107.534263
Nuclear repulsion energy	848.660096

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	733	704	169.62
2	A₁	390	374	0.15
3	A₁	248	238	0.32
4	A₁	155	148	0.01
5	A₂	178	171	0.00
6	B₁	688	661	154.67
7	B₁	235	225	0.36
8	B₂	772	741	173.72
9	B₂	268	257	0.17

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.404
Cl2	0.000	1.444	1.418
Cl3	0.000	-1.444	1.418
Br4	1.584	0.000	-0.723
Br5	-1.584	0.000	-0.723

	C1	Cl2	Cl3	Br4	Br5
C1		1.7645	1.7645	1.9445	1.9445
Cl2	1.7645		2.8878	3.0300	3.0300
Cl3	1.7645	2.8878		3.0300	3.0300
Br4	1.9445	3.0300	3.0300		3.1688
Br5	1.9445	3.0300	3.0300	3.1688

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	Cl3	109.830	Cl2	C1	Br4	109.463
Cl2	C1	Br5	109.463	Cl3	C1	Br4	109.463
Cl3	C1	Br5	109.463	Br4	C1	Br5	109.142

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)

using model chemistry: B1B95/6-311G**

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	-0.499
2	Cl	0.109
3	Cl	0.109
4	Br	0.141
5	Br	0.141

	x	y	z	Total
	0.000	0.000	-0.254	0.254
CHELPG
AIM
ESP

<r²>	393.922
(<r²>)^1/2	19.847

All results from a given calculation for CBr2Cl2 (dibromodichloromethane)

using model chemistry: B1B95/6-311G**

States and conformations

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)