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	hartrees
Energy at 0K	-2711.772040
Energy at 298.15K	-2711.777528
HF Energy	-2710.863706
Nuclear repulsion energy	165.465932

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3155	2992	21.82
2	A'	1526	1447	0.78
3	A'	1388	1317	71.95
4	A'	1123	1065	178.25
5	A'	677	642	61.46
6	A'	325	308	0.63
7	A"	3241	3074	9.09
8	A"	1286	1220	4.10
9	A"	969	920	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.513	-1.109	0.000
F2	-0.585	-1.909	0.000
Br3	0.000	0.754	0.000
H4	1.092	-1.283	0.904
H5	1.092	-1.283	-0.904

	C1	F2	Br3	H4	H5
C1		1.3589	1.9323	1.0875	1.0875
F2	1.3589		2.7271	2.0050	2.0050
Br3	1.9323	2.7271		2.4823	2.4823
H4	1.0875	2.0050	2.4823		1.8079
H5	1.0875	2.0050	2.4823	1.8079

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.707	F2	C1	H4	109.590
F2	C1	H5	109.590	Br3	C1	H4	107.234
Br3	C1	H5	107.234	H4	C1	H5	112.446

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-)