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	hartrees
Energy at 0K	-2711.531475
Energy at 298.15K	-2711.536927
HF Energy	-2710.923291
Nuclear repulsion energy	164.246953

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3126	3009
2	A'	1520	1463
3	A'	1377	1325
4	A'	1095	1054
5	A'	646	622
6	A'	314	302
7	A"	3212	3092
8	A"	1269	1221
9	A"	954	918

Atom	x (Å)	y (Å)	z (Å)
C1	0.517	-1.121	0.000
F2	-0.587	-1.923	0.000
Br3	0.000	0.761	0.000
H4	1.091	-1.298	0.906
H5	1.091	-1.298	-0.906

	C1	F2	Br3	H4	H5
C1		1.3648	1.9518	1.0870	1.0870
F2	1.3648		2.7472	2.0071	2.0071
Br3	1.9518	2.7472		2.4997	2.4997
H4	1.0870	2.0071	2.4997		1.8129
H5	1.0870	2.0071	2.4997	1.8129

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.601	F2	C1	H4	109.369
F2	C1	H5	109.369	Br3	C1	H4	107.234
Br3	C1	H5	107.234	H4	C1	H5	112.999

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

using model chemistry: CCSD(T)/TZVP

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: CCSD(T)/TZVP

States and conformations

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