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	hartrees
Energy at 0K	-2598.949769
Energy at 298.15K
HF Energy	-2598.814523
Nuclear repulsion energy	77.793533

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3194	3127
2	A₁	1432	1402
3	A₁	648	635
4	B₁	139i	136i
5	B₂	3353	3282
6	B₂	908	889

Atom	y (Å)	z (Å)
C1	0.000	-1.550
Br2	0.000	0.383
H3	0.957	-2.053
H4	-0.957	-2.053

	C1	Br2	H3	H4
C1		1.9332	1.0806	1.0806
Br2	1.9332		2.6169	2.6169
H3	1.0806	2.6169		1.9131
H4	1.0806	2.6169	1.9131

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	C1	H3	117.722		Br2	C1	H4	117.722
H3	C1	H4	124.557

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

using model chemistry: MP4=FULL/3-21G

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: MP4=FULL/3-21G

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

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