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	hartrees
Energy at 0K	-8215.964931
Energy at 298.15K	-8215.973553
HF Energy	-8214.737115
Nuclear repulsion energy	1134.604905

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	800	746	90.63
2	A₁	348	324	0.00
3	A₁	220	205	0.06
4	E	737	688	81.75
4	E	737	688	81.77
5	E	225	210	0.00
5	E	225	210	0.00
6	E	148	138	0.01
6	E	148	138	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.293
Cl2	0.000	0.000	2.055
Br3	0.000	1.818	-0.349
Br4	1.574	-0.909	-0.349
Br5	-1.574	-0.909	-0.349

	C1	Cl2	Br3	Br4	Br5
C1		1.7614	1.9281	1.9281	1.9281
Cl2	1.7614		3.0141	3.0141	3.0141
Br3	1.9281	3.0141		3.1485	3.1485
Br4	1.9281	3.0141	3.1485		3.1485
Br5	1.9281	3.0141	3.1485	3.1485

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	Br3	109.478	Cl2	C1	Br4	109.478
Cl2	C1	Br5	109.478	Br3	C1	Br4	109.464
Br3	C1	Br5	109.464	Br4	C1	Br5	109.464

All results from a given calculation for CBr₃Cl (tribromochloromethane)

using model chemistry: MP3=FULL/cc-pVTZ

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 CBr3Cl (tribromochloromethane)

using model chemistry: MP3=FULL/cc-pVTZ

States and conformations

All results from a given calculation for CBr₃Cl (tribromochloromethane)