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	hartrees
Energy at 0K	-5183.661320
Energy at 298.15K
HF Energy	-5183.157986
Nuclear repulsion energy	338.334728

Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
A'	3245	3060	1.13
A'	632	596	4.53
A'	411	388	22.00
A'	189	179	0.14
A"	1215	1146	60.52
A"	812	765	90.07

Atom	x (Å)	y (Å)	z (Å)
C1	0.006	0.825	0.000
H2	-0.438	1.808	0.000
Br3	0.006	-0.097	1.612
Br4	0.006	-0.097	-1.612

	C1	H2	Br3	Br4
C1		1.0785	1.8569	1.8569
H2	1.0785		2.5343	2.5343
Br3	1.8569	2.5343		3.2238
Br4	1.8569	2.5343	3.2238

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	Br3	116.896		H2	C1	Br4	116.896
Br3	C1	Br4	120.472

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

using model chemistry: CCSD/6-311+G(3df,2p)

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/6-311+G(3df,2p)

States and conformations

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