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	hartrees
Energy at 0K	-2807.818654
Energy at 298.15K	-2807.823617
HF Energy	-2807.198797
Nuclear repulsion energy	257.445016

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3229	3043	17.49
2	A'	1348	1270	114.57
3	A'	1146	1080	247.02
4	A'	728	686	120.83
5	A'	575	542	7.72
6	A'	322	303	0.20
7	A"	1424	1342	27.67
8	A"	1197	1128	184.92
9	A"	319	301	0.52

Atom	x (Å)	y (Å)	z (Å)
C1	-0.425	-0.923	0.000
H2	-1.514	-0.980	0.000
Br3	0.077	0.966	0.000
F4	0.077	-1.516	1.095
F5	0.077	-1.516	-1.095

	C1	H2	Br3	F4	F5
C1		1.0900	1.9549	1.3424	1.3424
H2	1.0900		2.5134	2.0038	2.0038
Br3	1.9549	2.5134		2.7129	2.7129
F4	1.3424	2.0038	2.7129		2.1899
F5	1.3424	2.0038	2.7129	2.1899

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	107.864	H2	C1	F4	110.503
H2	C1	F5	110.503	Br3	C1	F4	109.319
Br3	C1	F5	109.319	F4	C1	F5	109.304

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

using model chemistry: MP2=FULL/6-31G*

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: MP2=FULL/6-31G*

States and conformations

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