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	hartrees
Energy at 0K	-5286.069732
Energy at 298.15K
HF Energy	-5285.632146
Nuclear repulsion energy	479.045286

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'	3201	3201	3.05	74.38	0.27	0.42
2	A'	1356	1356	21.44	6.21	0.72	0.84
3	A'	1105	1105	200.97	1.49	0.70	0.82
4	A'	625	625	26.14	11.34	0.13	0.23
5	A'	359	359	0.57	5.74	0.20	0.34
6	A'	171	171	0.00	4.88	0.50	0.67
7	A"	1227	1227	103.97	3.43	0.75	0.86
8	A"	701	701	218.28	5.28	0.75	0.86
9	A"	299	299	0.14	2.97	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-0.102	0.788	0.000
H2	-1.007	1.384	0.000
F3	0.974	1.595	0.000
Br4	-0.102	-0.292	1.618
Br5	-0.102	-0.292	-1.618

	C1	H2	F3	Br4	Br5
C1		1.0834	1.3454	1.9454	1.9454
H2	1.0834		1.9928	2.4990	2.4990
F3	1.3454	1.9928		2.7089	2.7089
Br4	1.9454	2.4990	2.7089		3.2356
Br5	1.9454	2.4990	2.7089	3.2356

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.798	H2	C1	Br4	107.778
H2	C1	Br5	107.778	F3	C1	Br4	109.453
F3	C1	Br5	109.453	Br4	C1	Br5	112.532

All results from a given calculation for CHBr₂F (dibromofluoromethane)

using model chemistry: B2PLYP=FULL/6-311G*

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: B2PLYP=FULL/6-311G*

States and conformations

All results from a given calculation for CHBr₂F (dibromofluoromethane)