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	hartrees
Energy at 0K	-2810.447783
Energy at 298.15K
HF Energy	-2809.744655
Nuclear repulsion energy	257.431481

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3157	3039
2	A'	1343	1293
3	A'	1134	1092
4	A'	726	699
5	A'	585	563
6	A'	325	313
7	A"	1410	1358
8	A"	1177	1133
9	A"	320	308

Atom	x (Å)	y (Å)	z (Å)
C1	-0.424	-0.916	0.000
H2	-1.513	-0.992	0.000
Br3	0.077	0.965	0.000
F4	0.077	-1.517	1.089
F5	0.077	-1.517	-1.089

	C1	H2	Br3	F4	F5
C1		1.0913	1.9464	1.3409	1.3409
H2	1.0913		2.5213	1.9968	1.9968
Br3	1.9464	2.5213		2.7103	2.7103
F4	1.3409	1.9968	2.7103		2.1780
F5	1.3409	1.9968	2.7103	2.1780

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	108.923	H2	C1	F4	109.948
H2	C1	F5	109.948	Br3	C1	F4	109.697
Br3	C1	F5	109.697	F4	C1	F5	108.618

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

using model chemistry: CCSD(T)/6-311G*

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: CCSD(T)/6-311G*

States and conformations

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