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	hartrees
Energy at 0K	-2906.848690
Energy at 298.15K
HF Energy	-2906.062924
Nuclear repulsion energy	364.902210

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1111	1054
2	A₁	752	713
3	A₁	342	325
4	E	1280	1214
4	E	1280	1214
5	E	540	512
5	E	540	512
6	E	303	287
6	E	303	287

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.819
Br2	0.000	0.000	1.126
F3	0.000	1.254	-1.278
F4	1.086	-0.627	-1.278
F5	-1.086	-0.627	-1.278

	C1	Br2	F3	F4	F5
C1		1.9452	1.3356	1.3356	1.3356
Br2	1.9452		2.7119	2.7119	2.7119
F3	1.3356	2.7119		2.1723	2.1723
F4	1.3356	2.7119	2.1723		2.1723
F5	1.3356	2.7119	2.1723	2.1723

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	F3	110.110	Br2	C1	F4	110.110
Br2	C1	F5	110.110	F3	C1	F4	108.825
F3	C1	F5	108.825	F4	C1	F5	108.825

All results from a given calculation for CF₃Br (Bromotrifluoromethane)

using model chemistry: CCSD(T)/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 CF3Br (Bromotrifluoromethane)

using model chemistry: CCSD(T)/6-31G**

States and conformations

All results from a given calculation for CF₃Br (Bromotrifluoromethane)