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	hartrees
Energy at 0K	-5260.800465
Energy at 298.15K
HF Energy	-5260.635389
Nuclear repulsion energy	478.986421

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'	3199	3199	4.76	77.01	0.28	0.43
2	A'	1345	1345	17.54	7.53	0.75	0.86
3	A'	1098	1098	114.03	2.02	0.75	0.86
4	A'	629	629	23.11	11.21	0.10	0.18
5	A'	343	343	0.70	5.09	0.23	0.37
6	A'	171	171	0.03	3.98	0.50	0.66
7	A"	1237	1237	79.77	5.05	0.75	0.86
8	A"	699	699	187.28	5.61	0.75	0.86
9	A"	278	278	0.20	2.66	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	-0.105	0.810	0.000
H2	-1.024	1.386	0.000
F3	1.004	1.641	0.000
Br4	-0.105	-0.300	1.598
Br5	-0.105	-0.300	-1.598

	C1	H2	F3	Br4	Br5
C1		1.0839	1.3858	1.9463	1.9463
H2	1.0839		2.0434	2.4985	2.4985
F3	1.3858	2.0434		2.7485	2.7485
Br4	1.9463	2.4985	2.7485		3.1966
Br5	1.9463	2.4985	2.7485	3.1966

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	111.067	H2	C1	Br4	107.650
H2	C1	Br5	107.650	F3	C1	Br4	110.005
F3	C1	Br5	110.005	Br4	C1	Br5	110.413

All results from a given calculation for CHBr₂F (dibromofluoromethane)

using model chemistry: B2PLYP=FULL/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: B2PLYP=FULL/3-21G*

States and conformations

All results from a given calculation for CHBr₂F (dibromofluoromethane)