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	hartrees
Energy at 0K	-2611.839282
Energy at 298.15K
HF Energy	-2611.405848
Nuclear repulsion energy	80.447990

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3256	3040	4.99
2	A₁	1446	1350	26.16
3	A₁	709	662	17.80
4	B₁	215i	201i	80.83
5	B₂	3415	3189	0.32
6	B₂	959	896	1.68

Atom	y (Å)	z (Å)
C1	0.000	-1.492
Br2	0.000	0.370
H3	0.948	-1.993
H4	-0.948	-1.993

	C1	Br2	H3	H4
C1		1.8614	1.0728	1.0728
Br2	1.8614		2.5462	2.5462
H3	1.0728	2.5462		1.8967
H4	1.0728	2.5462	1.8967

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	C1	H3	117.876		Br2	C1	H4	117.876
H3	C1	H4	124.248

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

using model chemistry: MP3=FULL/TZVP

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: MP3=FULL/TZVP

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

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