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	hartrees
Energy at 0K	-2810.630863
Energy at 298.15K
HF Energy	-2809.819094
Nuclear repulsion energy	256.724231

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3171	3053
2	A'	1333	1284
3	A'	1110	1069
4	A'	717	690
5	A'	582	560
6	A'	321	309
7	A"	1399	1347
8	A"	1138	1096
9	A"	315	303

Atom	x (Å)	y (Å)	z (Å)
C1	-0.426	-0.915	0.000
H2	-1.511	-0.989	0.000
Br3	0.077	0.968	0.000
F4	0.077	-1.523	1.091
F5	0.077	-1.523	-1.091

	C1	H2	Br3	F4	F5
C1		1.0880	1.9494	1.3462	1.3462
H2	1.0880		2.5209	1.9993	1.9993
Br3	1.9494	2.5209		2.7194	2.7194
F4	1.3462	1.9993	2.7194		2.1820
F5	1.3462	1.9993	2.7194	2.1820

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	108.857	H2	C1	F4	109.988
H2	C1	F5	109.988	Br3	C1	F4	109.860
Br3	C1	F5	109.860	F4	C1	F5	108.281

All results from a given calculation for CHBrF₂ (Methane, bromodifluoro-)

using model chemistry: MP4/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 CHBrF2 (Methane, bromodifluoro-)

using model chemistry: MP4/TZVP

States and conformations

All results from a given calculation for CHBrF₂ (Methane, bromodifluoro-)