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	hartrees
Energy at 0K	-7846.482963
Energy at 298.15K	-7846.491941
HF Energy	-7846.482963
Nuclear repulsion energy	979.197945

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1162	1049	158.16
2	A₁	398	359	1.06
3	A₁	232	209	0.00
4	E	787	711	196.28
4	E	787	711	196.28
5	E	316	286	1.64
5	E	316	286	1.64
6	E	158	143	0.01
6	E	158	143	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.412
F2	0.000	0.000	1.787
Br3	0.000	1.862	-0.177
Br4	1.613	-0.931	-0.177
Br5	-1.613	-0.931	-0.177

	C1	F2	Br3	Br4	Br5
C1		1.3752	1.9531	1.9531	1.9531
F2	1.3752		2.7066	2.7066	2.7066
Br3	1.9531	2.7066		3.2253	3.2253
Br4	1.9531	2.7066	3.2253		3.2253
Br5	1.9531	2.7066	3.2253	3.2253

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	107.552	F2	C1	Br4	107.552
F2	C1	Br5	107.552	Br3	C1	Br4	111.320
Br3	C1	Br5	111.320	Br4	C1	Br5	111.320

All results from a given calculation for CFBr₃ (fluorotribromomethane)

using model chemistry: HF/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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Number	Element	Mulliken
1	C	-0.350
2	F	-0.338
3	Br	0.229
4	Br	0.229
5	Br	0.229

	x	y	z	Total
	0.000	0.000	-1.282	1.282
CHELPG
AIM
ESP

<r²>	438.319
(<r²>)^1/2	20.936

All results from a given calculation for CFBr3 (fluorotribromomethane)

using model chemistry: HF/6-31G

States and conformations

All results from a given calculation for CFBr₃ (fluorotribromomethane)