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	hartrees
Energy at 0K	-32.886345
Energy at 298.15K
HF Energy	-32.886345
Nuclear repulsion energy	32.976493

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3349	3019	19.54	150.89	0.07	0.13
2	A₁	1563	1409	1.86	29.79	0.54	0.71
3	A₁	590	532	8.87	46.07	0.13	0.23
4	A₁	179	161	0.18	10.55	0.55	0.71
5	A₂	1222	1101	0.00	21.55	0.75	0.86
6	B₁	3465	3123	1.38	80.20	0.75	0.86
7	B₁	895	807	8.87	8.33	0.75	0.86
8	B₂	1362	1227	138.72	0.12	0.75	0.86
9	B₂	678	611	126.47	30.42	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.951
H2	-0.896	0.000	1.550
H3	0.896	0.000	1.550
Br4	0.000	1.653	-0.126
Br5	0.000	-1.653	-0.126

	C1	H2	H3	Br4	Br5
C1		1.0776	1.0776	1.9725	1.9725
H2	1.0776		1.7923	2.5181	2.5181
H3	1.0776	1.7923		2.5181	2.5181
Br4	1.9725	2.5181	2.5181		3.3052
Br5	1.9725	2.5181	2.5181	3.3052

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	112.533	H2	C1	Br4	107.649
H2	C1	Br5	107.649	H3	C1	Br4	107.649
H3	C1	Br5	107.649	Br4	C1	Br5	113.819

All results from a given calculation for CH₂Br₂ (dibromomethane)

using model chemistry: HF/CEP-31G

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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Number	Element	Mulliken
1	C	-0.565
2	H	0.226
3	H	0.226
4	Br	0.057
5	Br	0.057

	x	y	z	Total
	0.000	0.000	2.053	2.053
CHELPG
AIM
ESP

<r²>	71.669
(<r²>)^1/2	8.466

All results from a given calculation for CH2Br2 (dibromomethane)

using model chemistry: HF/CEP-31G

States and conformations

All results from a given calculation for CH₂Br₂ (dibromomethane)