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	hartrees
Energy at 0K	-5280.921166
Energy at 298.15K
HF Energy	-5280.720822
Nuclear repulsion energy	481.151112

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'	3219	3061	0.02	71.81	0.24	0.39
2	A'	1324	1259	16.56	4.73	0.59	0.75
3	A'	1069	1017	192.54	2.25	0.68	0.81
4	A'	626	596	26.18	14.17	0.06	0.11
5	A'	358	340	0.22	5.31	0.14	0.24
6	A'	175	166	0.00	3.33	0.46	0.63
7	A"	1221	1161	92.68	2.69	0.75	0.86
8	A"	700	666	200.34	5.75	0.75	0.86
9	A"	297	283	0.01	2.41	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-0.105	0.794	0.000
H2	-0.996	1.412	0.000
F3	1.001	1.588	0.000
Br4	-0.105	-0.292	1.603
Br5	-0.105	-0.292	-1.603

	C1	H2	F3	Br4	Br5
C1		1.0842	1.3615	1.9367	1.9367
H2	1.0842		2.0050	2.5038	2.5038
F3	1.3615	2.0050		2.7071	2.7071
Br4	1.9367	2.5038	2.7071		3.2066
Br5	1.9367	2.5038	2.7071	3.2066

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.614	H2	C1	Br4	108.644
H2	C1	Br5	108.644	F3	C1	Br4	109.082
F3	C1	Br5	109.082	Br4	C1	Br5	111.754

All results from a given calculation for CHBr₂F (dibromofluoromethane)

using model chemistry: B2PLYP=FULL/6-31+G**

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/6-31+G**

States and conformations

All results from a given calculation for CHBr₂F (dibromofluoromethane)