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	hartrees
Energy at 0K	-6102.827932
Energy at 298.15K	-6102.833905
HF Energy	-6101.795955
Nuclear repulsion energy	850.186255

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	790	738	101.37
2	A₁	395	369	0.05
3	A₁	251	234	0.00
4	A₁	159	149	0.02
5	A₂	180	168	0.00
6	B₁	747	697	96.44
7	B₁	239	223	0.00
8	B₂	820	765	100.09
9	B₂	272	254	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.394
Cl2	0.000	1.444	1.416
Cl3	0.000	-1.444	1.416
Br4	1.581	0.000	-0.722
Br5	-1.581	0.000	-0.722

	C1	Cl2	Cl3	Br4	Br5
C1		1.7686	1.7686	1.9351	1.9351
Cl2	1.7686		2.8872	3.0253	3.0253
Cl3	1.7686	2.8872		3.0253	3.0253
Br4	1.9351	3.0253	3.0253		3.1618
Br5	1.9351	3.0253	3.0253	3.1618

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	Cl3	109.424	Cl2	C1	Br4	109.460
Cl2	C1	Br5	109.460	Cl3	C1	Br4	109.460
Cl3	C1	Br5	109.460	Br4	C1	Br5	109.563

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)

using model chemistry: CCD/cc-pVTZ

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: CCD/cc-pVTZ

States and conformations

All results from a given calculation for CBr₂Cl₂ (dibromodichloromethane)