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	hartrees
Energy at 0K	-2711.756192
Energy at 298.15K	-2711.761675
HF Energy	-2710.859935
Nuclear repulsion energy	165.262366

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3156	2989	21.20
2	A'	1543	1462	0.14
3	A'	1402	1328	70.07
4	A'	1119	1060	181.00
5	A'	673	638	64.83
6	A'	324	307	0.61
7	A"	3246	3074	8.60
8	A"	1293	1224	3.96
9	A"	982	930	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.514	-1.111	0.000
F2	-0.585	-1.911	0.000
Br3	0.000	0.756	0.000
H4	1.090	-1.290	0.904
H5	1.090	-1.290	-0.904

	C1	F2	Br3	H4	H5
C1		1.3594	1.9359	1.0869	1.0869
F2	1.3594		2.7301	2.0019	2.0019
Br3	1.9359	2.7301		2.4880	2.4880
H4	1.0869	2.0019	2.4880		1.8086
H5	1.0869	2.0019	2.4880	1.8086

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.673	F2	C1	H4	109.335
F2	C1	H5	109.335	Br3	C1	H4	107.437
Br3	C1	H5	107.437	H4	C1	H5	112.604

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

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

using model chemistry: MP2=FULL/6-311G*

States and conformations

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