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	hartrees
Energy at 0K	-2711.338554
Energy at 298.15K	-2711.343998
HF Energy	-2710.846264
Nuclear repulsion energy	163.911166

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3105	2960
2	A'	1494	1424
3	A'	1341	1278
4	A'	1109	1057
5	A'	646	616
6	A'	312	298
7	A"	3189	3040
8	A"	1249	1190
9	A"	941	897

Atom	x (Å)	y (Å)	z (Å)
C1	0.516	-1.124	0.000
F2	-0.589	-1.925	0.000
Br3	0.000	0.762	0.000
H4	1.105	-1.295	0.915
H5	1.105	-1.295	-0.915

	C1	F2	Br3	H4	H5
C1		1.3651	1.9545	1.1016	1.1016
F2	1.3651		2.7510	2.0257	2.0257
Br3	1.9545	2.7510		2.5075	2.5075
H4	1.1016	2.0257	2.5075		1.8297
H5	1.1016	2.0257	2.5075	1.8297

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.681	F2	C1	H4	109.959
F2	C1	H5	109.959	Br3	C1	H4	106.933
Br3	C1	H5	106.933	H4	C1	H5	112.300

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

using model chemistry: QCISD(T)/cc-pVDZ

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: QCISD(T)/cc-pVDZ

States and conformations

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