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	hartrees
Energy at 0K	-5742.774623
Energy at 298.15K
HF Energy	-5741.643903
Nuclear repulsion energy	731.357446

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'	1099	1047	188.14	1.40	0.61	0.76
2	A'	831	792	221.44	3.94	0.66	0.80
3	A'	473	451	1.17	5.46	0.04	0.08
4	A'	353	336	0.00	3.26	0.60	0.75
5	A'	274	261	0.30	7.08	0.25	0.39
6	A'	165	157	0.08	3.30	0.66	0.80
7	A"	776	739	233.76	6.13	0.75	0.86
8	A"	318	303	0.01	3.36	0.75	0.86
9	A"	201	192	0.10	3.35	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-0.130	0.510	0.000
F2	-1.258	1.238	0.000
Cl3	1.249	1.616	0.000
Br4	-0.130	-0.595	1.598
Br5	-0.130	-0.595	-1.598

	C1	F2	Cl3	Br4	Br5
C1		1.3426	1.7678	1.9429	1.9429
F2	1.3426		2.5354	2.6809	2.6809
Cl3	1.7678	2.5354		3.0572	3.0572
Br4	1.9429	2.6809	3.0572		3.1952
Br5	1.9429	2.6809	3.0572	3.1952

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	108.425	F2	C1	Br4	107.975
F2	C1	Br5	107.975	Cl3	C1	Br4	110.862
Cl3	C1	Br5	110.862	Br4	C1	Br5	110.625

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)

using model chemistry: MP2=FULL/TZVP

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 CBr2ClF (dibromochlorofluoromethane)

using model chemistry: MP2=FULL/TZVP

States and conformations

All results from a given calculation for CBr₂ClF (dibromochlorofluoromethane)