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	hartrees
Energy at 0K	-5184.633079
Energy at 298.15K
HF Energy	-5183.964254
Nuclear repulsion energy	353.886797

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3168	3032	1.47
2	A₁	1477	1413	0.00
3	A₁	611	584	3.14
4	A₁	178	170	0.09
5	A₂	1154	1104	0.00
6	B₁	3248	3108	2.26
7	B₁	843	806	3.22
8	B₂	1260	1205	59.53
9	B₂	706	675	62.85

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.930
H2	-0.895	0.000	1.536
H3	0.895	0.000	1.536
Br4	0.000	1.604	-0.124
Br5	0.000	-1.604	-0.124

	C1	H2	H3	Br4	Br5
C1		1.0808	1.0808	1.9197	1.9197
H2	1.0808		1.7898	2.4761	2.4761
H3	1.0808	1.7898		2.4761	2.4761
Br4	1.9197	2.4761	2.4761		3.2088
Br5	1.9197	2.4761	2.4761	3.2088

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	111.789	H2	C1	Br4	107.932
H2	C1	Br5	107.932	H3	C1	Br4	107.932
H3	C1	Br5	107.932	Br4	C1	Br5	113.391

All results from a given calculation for CH₂Br₂ (dibromomethane)

using model chemistry: CCD/aug-cc-pVTZ

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/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂Br₂ (dibromomethane)