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	hartrees
Energy at 0K	-454.899855
Energy at 298.15K
HF Energy	-454.503225
Nuclear repulsion energy	59.626345

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3204	3056	5.12
2	A₁	1416	1351	20.81
3	A₁	724	691	14.69
4	B₁	94	90	65.14
5	B₂	3355	3200	0.54
6	B₂	939	896	0.94

Atom	y (Å)	z (Å)
C1	0.000	-1.479
Br2	0.000	0.367
H3	0.949	-1.983
H4	-0.949	-1.983

	C1	Br2	H3	H4
C1		1.8459	1.0748	1.0748
Br2	1.8459		2.5347	2.5347
H3	1.0748	2.5347		1.8981
H4	1.0748	2.5347	1.8981

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	C1	H3	117.990		Br2	C1	H4	117.990
H3	C1	H4	124.020

All results from a given calculation for CH₂Br (bromomethyl radical)

using model chemistry: CCSD/cc-pVTZ-PP

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

	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 CH2Br (bromomethyl radical)

using model chemistry: CCSD/cc-pVTZ-PP

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

All results from a given calculation for CH₂Br (bromomethyl radical)