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	hartrees
Energy at 0K	-2708.834863
Energy at 298.15K	-2708.840327
HF Energy	-2708.366212
Nuclear repulsion energy	164.861839

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3201	3006	13.86
2	A'	1538	1444	0.45
3	A'	1391	1306	68.44
4	A'	1074	1009	187.80
5	A'	666	626	66.83
6	A'	318	298	0.86
7	A"	3300	3099	2.08
8	A"	1267	1190	3.22
9	A"	979	920	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.525	-1.105	0.000
F2	-0.592	-1.916	0.000
Br3	0.000	0.756	0.000
H4	1.090	-1.292	0.905
H5	1.090	-1.292	-0.905

	C1	F2	Br3	H4	H5
C1		1.3803	1.9335	1.0833	1.0833
F2	1.3803		2.7363	2.0096	2.0096
Br3	1.9335	2.7363		2.4905	2.4905
H4	1.0833	2.0096	2.4905		1.8097
H5	1.0833	2.0096	2.4905	1.8097

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.207	F2	C1	H4	108.716
F2	C1	H5	108.716	Br3	C1	H4	107.948
Br3	C1	H5	107.948	H4	C1	H5	113.291

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

using model chemistry: MP2=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 CH2BrF (Methane, bromofluoro-)

using model chemistry: MP2=FULL/6-31+G**

States and conformations

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