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	hartrees
Energy at 0K	-2708.416562
Energy at 298.15K	-2708.421936
HF Energy	-2708.163670
Nuclear repulsion energy	159.917423

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3175	3038	16.53
2	A'	1541	1474	3.01
3	A'	1378	1318	57.66
4	A'	1015	972	120.05
5	A'	606	580	58.70
6	A'	289	276	1.05
7	A"	3277	3136	8.77
8	A"	1229	1176	2.43
9	A"	943	903	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.548	-1.142	0.000
F2	-0.613	-1.977	0.000
Br3	0.000	0.780	0.000
H4	1.113	-1.321	0.912
H5	1.113	-1.321	-0.912

	C1	F2	Br3	H4	H5
C1		1.4301	1.9982	1.0877	1.0877
F2	1.4301		2.8242	2.0590	2.0590
Br3	1.9982	2.8242		2.5465	2.5465
H4	1.0877	2.0590	2.5465		1.8245
H5	1.0877	2.0590	2.5465	1.8245

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	109.821	F2	C1	H4	108.961
F2	C1	H5	108.961	Br3	C1	H4	107.519
Br3	C1	H5	107.519	H4	C1	H5	114.000

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

using model chemistry: MP2/6-31G

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: MP2/6-31G

States and conformations

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