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	hartrees
Energy at 0K	-43.829006
Energy at 298.15K	-43.834385
HF Energy	-43.592258
Nuclear repulsion energy	37.383894

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3084	3010	24.89
2	A'	1472	1436	5.02
3	A'	1370	1337	62.54
4	A'	951	928	152.54
5	A'	623	608	57.14
6	A'	288	281	1.69
7	A"	3208	3131	11.89
8	A"	1198	1169	4.45
9	A"	941	918	0.12

Atom	x (Å)	y (Å)	z (Å)
C1	0.559	-1.135	0.000
F2	-0.619	-1.988	0.000
Br3	0.000	0.782	0.000
H4	1.110	-1.338	0.922
H5	1.110	-1.338	-0.922

	C1	F2	Br3	H4	H5
C1		1.4538	1.9971	1.0932	1.0932
F2	1.4538		2.8381	2.0641	2.0641
Br3	1.9971	2.8381		2.5650	2.5650
H4	1.0932	2.0641	2.5650		1.8439
H5	1.0932	2.0641	2.5650	1.8439

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	109.654	F2	C1	H4	107.422
F2	C1	H5	107.422	Br3	C1	H4	108.638
Br3	C1	H5	108.638	H4	C1	H5	114.984

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

using model chemistry: MP2/CEP-121G

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/CEP-121G

States and conformations

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