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	hartrees
Energy at 0K	-5284.269640
Energy at 298.15K
HF Energy	-5282.666196
Nuclear repulsion energy	484.961031

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3225	3225	0.04
2	A'	1372	1372	12.85
3	A'	1156	1156	164.79
4	A'	651	651	18.75
5	A'	377	377	0.28
6	A'	179	179	0.00
7	A"	1243	1243	72.44
8	A"	763	763	152.59
9	A"	314	314	0.31

Atom	x (Å)	y (Å)	z (Å)
C1	-0.101	0.779	0.000
H2	-1.003	1.374	0.000
F3	0.968	1.578	0.000
Br4	-0.101	-0.289	1.596
Br5	-0.101	-0.289	-1.596

	C1	H2	F3	Br4	Br5
C1		1.0802	1.3353	1.9204	1.9204
H2	1.0802		1.9821	2.4749	2.4749
F3	1.3353	1.9821		2.6792	2.6792
Br4	1.9204	2.4749	2.6792		3.1920
Br5	1.9204	2.4749	2.6792	3.1920

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.841	H2	C1	Br4	107.832
H2	C1	Br5	107.832	F3	C1	Br4	109.439
F3	C1	Br5	109.439	Br4	C1	Br5	112.414

All results from a given calculation for CHBr₂F (dibromofluoromethane)

using model chemistry: MP3=FULL/6-311+G(3df,2p)

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 CHBr2F (dibromofluoromethane)

using model chemistry: MP3=FULL/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CHBr₂F (dibromofluoromethane)