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	hartrees
Energy at 0K	-5184.223218
Energy at 298.15K
HF Energy	-5183.793904
Nuclear repulsion energy	349.941440

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3159	3023	4.73
2	A₁	1450	1387	0.26
3	A₁	598	572	3.84
4	A₁	176	169	0.09
5	A₂	1138	1088	0.00
6	B₁	3246	3106	0.13
7	B₁	825	789	4.30
8	B₂	1243	1189	65.15
9	B₂	690	660	64.53

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.935
H2	-0.907	0.000	1.553
H3	0.907	0.000	1.553
Br4	0.000	1.624	-0.124
Br5	0.000	-1.624	-0.124

	C1	H2	H3	Br4	Br5
C1		1.0972	1.0972	1.9385	1.9385
H2	1.0972		1.8131	2.5041	2.5041
H3	1.0972	1.8131		2.5041	2.5041
Br4	1.9385	2.5041	2.5041		3.2473
Br5	1.9385	2.5041	2.5041	3.2473

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	111.431	H2	C1	Br4	107.922
H2	C1	Br5	107.922	H3	C1	Br4	107.922
H3	C1	Br5	107.922	Br4	C1	Br5	113.775

All results from a given calculation for CH₂Br₂ (dibromomethane)

using model chemistry: CCD/cc-pVDZ

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: CCD/cc-pVDZ

States and conformations

All results from a given calculation for CH₂Br₂ (dibromomethane)