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	hartrees
Energy at 0K	-3629.982666
Energy at 298.15K	-3629.986362
HF Energy	-3628.822582
Nuclear repulsion energy	528.688632

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	1117	1060	168.35	1.20	0.59	0.74
2	A'	823	782	236.92	4.42	0.67	0.80
3	A'	517	491	1.51	8.43	0.01	0.02
4	A'	347	329	0.03	2.55	0.74	0.85
5	A'	314	298	0.12	4.96	0.24	0.39
6	A'	223	212	0.05	2.63	0.64	0.78
7	A"	860	817	222.16	2.30	0.75	0.86
8	A"	402	382	0.02	2.63	0.75	0.86
9	A"	209	198	0.03	2.35	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.523	0.136	0.000
Br2	-1.391	0.316	0.000
F3	1.059	1.361	0.000
Cl4	1.059	-0.710	1.443
Cl5	1.059	-0.710	-1.443

	C1	Br2	F3	Cl4	Cl5
C1		1.9223	1.3371	1.7564	1.7564
Br2	1.9223		2.6643	3.0230	3.0230
F3	1.3371	2.6643		2.5236	2.5236
Cl4	1.7564	3.0230	2.5236		2.8852
Cl5	1.7564	3.0230	2.5236	2.8852

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	F3	108.315	Br2	C1	Cl4	110.440
Br2	C1	Cl5	110.440	F3	C1	Cl4	108.570
F3	C1	Cl5	108.570	Cl4	C1	Cl5	110.438

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)

using model chemistry: MP2=FULL/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 CBrCl2F (bromodichlorofluoromethane)

using model chemistry: MP2=FULL/cc-pVTZ

States and conformations

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)