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	hartrees
Energy at 0K	-6102.326711
Energy at 298.15K	-6102.332667
HF Energy	-6101.596323
Nuclear repulsion energy	842.872351

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	777	731	122.55
2	A₁	392	369	0.13
3	A₁	251	236	0.02
4	A₁	161	151	0.01
5	A₂	183	172	0.00
6	B₁	728	684	115.91
7	B₁	239	225	0.01
8	B₂	811	763	121.47
9	B₂	273	257	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.401
Cl2	0.000	1.454	1.428
Cl3	0.000	-1.454	1.428
Br4	1.596	0.000	-0.728
Br5	-1.596	0.000	-0.728

	C1	Cl2	Cl3	Br4	Br5
C1		1.7800	1.7800	1.9548	1.9548
Cl2	1.7800		2.9086	3.0507	3.0507
Cl3	1.7800	2.9086		3.0507	3.0507
Br4	1.9548	3.0507	3.0507		3.1915
Br5	1.9548	3.0507	3.0507	3.1915

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	Cl3	109.575	Cl2	C1	Br4	109.453
Cl2	C1	Br5	109.453	Cl3	C1	Br4	109.453
Cl3	C1	Br5	109.453	Br4	C1	Br5	109.439

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)

using model chemistry: MP3=FULL/cc-pVDZ

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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All results from a given calculation for CBr2Cl2 (dibromodichloromethane)

using model chemistry: MP3=FULL/cc-pVDZ

States and conformations

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)