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	hartrees
Energy at 0K	-5257.520741
Energy at 298.15K
HF Energy	-5257.211060
Nuclear repulsion energy	463.246863

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3183	3085	8.31
2	A'	1335	1294	18.97
3	A'	1102	1068	115.50
4	A'	575	557	22.90
5	A'	320	310	1.47
6	A'	160	155	0.10
7	A"	1215	1177	93.17
8	A"	679	658	149.73
9	A"	274	265	0.09

Atom	x (Å)	y (Å)	z (Å)
C1	-0.106	0.813	0.000
H2	-1.026	1.392	0.000
F3	1.010	1.644	0.000
Br4	-0.106	-0.301	1.676
Br5	-0.106	-0.301	-1.676

	C1	H2	F3	Br4	Br5
C1		1.0865	1.3918	2.0122	2.0122
H2	1.0865		2.0514	2.5533	2.5533
F3	1.3918	2.0514		2.7995	2.7995
Br4	2.0122	2.5533	2.7995		3.3514
Br5	2.0122	2.5533	2.7995	3.3514

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	111.138	H2	C1	Br4	107.158
H2	C1	Br5	107.158	F3	C1	Br4	109.302
F3	C1	Br5	109.302	Br4	C1	Br5	112.770

All results from a given calculation for CHBr₂F (dibromofluoromethane)

using model chemistry: QCISD/3-21G

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: QCISD/3-21G

States and conformations

All results from a given calculation for CHBr₂F (dibromofluoromethane)