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	hartrees
Energy at 0K	-2708.769619
Energy at 298.15K	-2708.775078
HF Energy	-2708.341185
Nuclear repulsion energy	164.303147

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3183	2987	15.57
2	A'	1564	1468	0.35
3	A'	1391	1306	71.59
4	A'	1153	1082	159.93
5	A'	657	616	59.96
6	A'	315	296	0.60
7	A"	3268	3068	8.01
8	A"	1287	1208	3.02
9	A"	971	912	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	0.520	-1.125	0.000
F2	-0.590	-1.917	0.000
Br3	0.000	0.760	0.000
H4	1.096	-1.296	0.906
H5	1.096	-1.296	-0.906

	C1	F2	Br3	H4	H5
C1		1.3635	1.9547	1.0875	1.0875
F2	1.3635		2.7411	2.0123	2.0123
Br3	1.9547	2.7411		2.5000	2.5000
H4	1.0875	2.0123	2.5000		1.8116
H5	1.0875	2.0123	2.5000	1.8116

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.120	F2	C1	H4	109.866
F2	C1	H5	109.866	Br3	C1	H4	107.049
Br3	C1	H5	107.049	H4	C1	H5	112.802

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

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

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