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	hartrees
Energy at 0K	-5161.671937
Energy at 298.15K
HF Energy	-5161.612507
Nuclear repulsion energy	340.972340

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3197	3044	3.53
2	A₁	1505	1433	0.02
3	A₁	550	523	4.49
4	A₁	166	158	0.07
5	A₂	1154	1099	0.00
6	B₁	3284	3126	0.02
7	B₁	815	776	8.79
8	B₂	1262	1201	65.87
9	B₂	644	614	89.55

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.952
H2	-0.898	0.000	1.555
H3	0.898	0.000	1.555
Br4	0.000	1.672	-0.126
Br5	0.000	-1.672	-0.126

	C1	H2	H3	Br4	Br5
C1		1.0821	1.0821	1.9894	1.9894
H2	1.0821		1.7969	2.5356	2.5356
H3	1.0821	1.7969		2.5356	2.5356
Br4	1.9894	2.5356	2.5356		3.3437
Br5	1.9894	2.5356	2.5356	3.3437

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	112.249	H2	C1	Br4	107.583
H2	C1	Br5	107.583	H3	C1	Br4	107.583
H3	C1	Br5	107.583	Br4	C1	Br5	114.365

All results from a given calculation for CH₂Br₂ (dibromomethane)

using model chemistry: B2PLYP=FULL/3-21G

States and conformations

	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 CH2Br2 (dibromomethane)

using model chemistry: B2PLYP=FULL/3-21G

States and conformations

All results from a given calculation for CH₂Br₂ (dibromomethane)