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	hartrees
Energy at 0K	-6102.290687
Energy at 298.15K	-6102.296645
HF Energy	-6102.290687
Nuclear repulsion energy	856.583511

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	767	731	115.24
2	A₁	398	379	0.00
3	A₁	250	238	0.00
4	A₁	165	157	0.03
5	A₂	180	171	0.00
6	B₁	762	725	107.24
7	B₁	240	229	0.02
8	B₂	776	739	119.22
9	B₂	277	264	0.15

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.380
Cl2	0.000	1.443	1.408
Cl3	0.000	-1.443	1.408
Br4	1.564	0.000	-0.716
Br5	-1.564	0.000	-0.716

	C1	Cl2	Cl3	Br4	Br5
C1		1.7713	1.7713	1.9095	1.9095
Cl2	1.7713		2.8852	3.0061	3.0061
Cl3	1.7713	2.8852		3.0061	3.0061
Br4	1.9095	3.0061	3.0061		3.1274
Br5	1.9095	3.0061	3.0061	3.1274

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	Cl3	109.064	Cl2	C1	Br4	109.452
Cl2	C1	Br5	109.452	Cl3	C1	Br4	109.452
Cl3	C1	Br5	109.452	Br4	C1	Br5	109.952

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)

using model chemistry: M06-2X/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	-0.225
2	Cl	-0.018
3	Cl	-0.018
4	Br	0.130
5	Br	0.130

	x	y	z	Total
	0.000	0.000	-0.300	0.300
CHELPG
AIM
ESP

<r²>	386.943
(<r²>)^1/2	19.671

All results from a given calculation for CBr2Cl2 (dibromodichloromethane)

using model chemistry: M06-2X/6-31G(2df,p)

States and conformations

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)