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	hartrees
Energy at 0K	-2611.629603
Energy at 298.15K
HF Energy	-2611.356123
Nuclear repulsion energy	80.202094

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3160	3043
2	A₁	1414	1361
3	A₁	703	677
4	B₁	174i	168i
5	B₂	3313	3190
6	B₂	948	913

Atom	y (Å)	z (Å)
C1	0.000	-1.495
Br2	0.000	0.371
H3	0.956	-2.002
H4	-0.956	-2.002

	C1	Br2	H3	H4
C1		1.8652	1.0826	1.0826
Br2	1.8652		2.5582	2.5582
H3	1.0826	2.5582		1.9125
H4	1.0826	2.5582	1.9125

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	C1	H3	117.960		Br2	C1	H4	117.960
H3	C1	H4	124.080

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

using model chemistry: QCISD(T)/6-311G*

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: QCISD(T)/6-311G*

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

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