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	hartrees
Energy at 0K	-2711.697276
Energy at 298.15K	-2711.702766
HF Energy	-2710.974378
Nuclear repulsion energy	166.441644

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3162	3002	15.86
2	A'	1529	1452	0.07
3	A'	1368	1299	47.58
4	A'	1120	1064	174.25
5	A'	684	650	58.33
6	A'	324	308	0.60
7	A"	3230	3067	3.70
8	A"	1280	1215	2.81
9	A"	963	914	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.512	-1.099	0.000
F2	-0.583	-1.900	0.000
Br3	0.000	0.750	0.000
H4	1.087	-1.271	0.897
H5	1.087	-1.271	-0.897

	C1	F2	Br3	H4	H5
C1		1.3557	1.9183	1.0796	1.0796
F2	1.3557		2.7126	1.9969	1.9969
Br3	1.9183	2.7126		2.4633	2.4633
H4	1.0796	1.9969	2.4633		1.7946
H5	1.0796	1.9969	2.4633	1.7946

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.722	F2	C1	H4	109.650
F2	C1	H5	109.650	Br3	C1	H4	107.167
Br3	C1	H5	107.167	H4	C1	H5	112.439

All results from a given calculation for CH₂BrF (Methane, bromofluoro-)

using model chemistry: MP2=FULL/cc-pVTZ

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 CH2BrF (Methane, bromofluoro-)

using model chemistry: MP2=FULL/cc-pVTZ

States and conformations

All results from a given calculation for CH₂BrF (Methane, bromofluoro-)