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	hartrees
Energy at 0K	-2810.345719
Energy at 298.15K	-2810.350711
HF Energy	-2809.708065
Nuclear repulsion energy	257.407378

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3193	3041	23.21
2	A'	1319	1256	111.35
3	A'	1136	1082	276.66
4	A'	729	695	120.60
5	A'	586	558	7.24
6	A'	327	311	0.28
7	A"	1397	1330	31.03
8	A"	1188	1132	212.37
9	A"	321	305	0.53

Atom	x (Å)	y (Å)	z (Å)
C1	-0.424	-0.914	0.000
H2	-1.521	-0.976	0.000
Br3	0.077	0.964	0.000
F4	0.077	-1.516	1.091
F5	0.077	-1.516	-1.091

	C1	H2	Br3	F4	F5
C1		1.0984	1.9441	1.3429	1.3429
H2	1.0984		2.5132	2.0084	2.0084
Br3	1.9441	2.5132		2.7093	2.7093
F4	1.3429	2.0084	2.7093		2.1829
F5	1.3429	2.0084	2.7093	2.1829

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	108.151	H2	C1	F4	110.306
H2	C1	F5	110.306	Br3	C1	F4	109.670
Br3	C1	F5	109.670	F4	C1	F5	108.728

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

using model chemistry: MP2/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 CHBrF2 (Methane, bromodifluoro-)

using model chemistry: MP2/cc-pVDZ

States and conformations

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