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	hartrees
Energy at 0K	-5183.584945
Energy at 298.15K
HF Energy	-5183.166598
Nuclear repulsion energy	335.821663

Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
A'	3249	3249	0.92
A'	626	626	7.84
A'	450	450	23.60
A'	187	187	0.10
A"	1192	1192	61.69
A"	796	796	99.38

Atom	x (Å)	y (Å)	z (Å)
C1	0.006	0.837	0.000
H2	-0.489	1.811	0.000
Br3	0.006	-0.098	1.623
Br4	0.006	-0.098	-1.623

	C1	H2	Br3	Br4
C1		1.0932	1.8725	1.8725
H2	1.0932		2.5539	2.5539
Br3	1.8725	2.5539		3.2458
Br4	1.8725	2.5539	3.2458

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	Br3	116.409		H2	C1	Br4	116.409
Br3	C1	Br4	120.153

All results from a given calculation for CHBr₂ (dibromomethyl radical)

using model chemistry: CCSD=FULL/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 CHBr2 (dibromomethyl radical)

using model chemistry: CCSD=FULL/cc-pVDZ

States and conformations

All results from a given calculation for CHBr₂ (dibromomethyl radical)