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	hartrees
Energy at 0K	-2711.775481
Energy at 298.15K	-2711.780949
HF Energy	-2710.976872
Nuclear repulsion energy	165.971400

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3135	3038
2	A'	1518	1471
3	A'	1354	1313
4	A'	1072	1039
5	A'	675	654
6	A'	318	308
7	A"	3191	3093
8	A"	1255	1217
9	A"	957	928

Atom	x (Å)	y (Å)	z (Å)
C1	0.518	-1.100	0.000
F2	-0.588	-1.902	0.000
Br3	0.000	0.751	0.000
H4	1.089	-1.278	0.903
H5	1.089	-1.278	-0.903

	C1	F2	Br3	H4	H5
C1		1.3664	1.9216	1.0828	1.0828
F2	1.3664		2.7175	2.0040	2.0040
Br3	1.9216	2.7175		2.4733	2.4733
H4	1.0828	2.0040	2.4733		1.8052
H5	1.0828	2.0040	2.4733	1.8052

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.335	F2	C1	H4	109.264
F2	C1	H5	109.264	Br3	C1	H4	107.508
Br3	C1	H5	107.508	H4	C1	H5	112.931

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

using model chemistry: MP4=FULL/aug-cc-pVTZ

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: MP4=FULL/aug-cc-pVTZ

States and conformations

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