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	hartrees
Energy at 0K	-2708.814185
Energy at 298.15K	-2708.819654
HF Energy	-2708.366469
Nuclear repulsion energy	164.620292

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3216	2992	13.49
2	A'	1550	1442	0.18
3	A'	1397	1300	72.17
4	A'	1114	1037	185.11
5	A'	662	616	61.20
6	A'	318	296	0.97
7	A"	3307	3077	2.98
8	A"	1279	1190	3.82
9	A"	979	911	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.523	-1.114	0.000
F2	-0.591	-1.915	0.000
Br3	0.000	0.758	0.000
H4	1.090	-1.300	0.904
H5	1.090	-1.300	-0.904

	C1	F2	Br3	H4	H5
C1		1.3727	1.9435	1.0827	1.0827
F2	1.3727		2.7377	2.0053	2.0053
Br3	1.9435	2.7377		2.4978	2.4978
H4	1.0827	2.0053	2.4978		1.8073
H5	1.0827	2.0053	2.4978	1.8073

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.095	F2	C1	H4	108.939
F2	C1	H5	108.939	Br3	C1	H4	107.843
Br3	C1	H5	107.843	H4	C1	H5	113.157

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

using model chemistry: MP3/6-31+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: MP3/6-31+G**

States and conformations

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