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	hartrees
Energy at 0K	-2611.619288
Energy at 298.15K
HF Energy	-2611.367789
Nuclear repulsion energy	80.333280

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3253	3006	4.45
2	A₁	1420	1312	25.16
3	A₁	727	672	16.92
4	B₁	251i	232i	66.22
5	B₂	3411	3151	0.69
6	B₂	942	870	0.94

Atom	y (Å)	z (Å)
C1	0.000	-1.490
Br2	0.000	0.370
H3	0.959	-2.002
H4	-0.959	-2.002

	C1	Br2	H3	H4
C1		1.8603	1.0871	1.0871
Br2	1.8603		2.5584	2.5584
H3	1.0871	2.5584		1.9185
H4	1.0871	2.5584	1.9185

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	C1	H3	118.068		Br2	C1	H4	118.068
H3	C1	H4	123.864

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

using model chemistry: CID/cc-pVDZ

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: CID/cc-pVDZ

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

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