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	hartrees
Energy at 0K	-5184.323329
Energy at 298.15K
HF Energy	-5183.786977
Nuclear repulsion energy	352.186878

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3155	2976	1.54
2	A₁	1477	1393	0.00
3	A₁	603	569	3.09
4	A₁	177	167	0.08
5	A₂	1152	1087	0.00
6	B₁	3236	3052	2.04
7	B₁	838	790	3.43
8	B₂	1255	1183	61.41
9	B₂	693	654	67.25

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.933
H2	-0.895	0.000	1.540
H3	0.895	0.000	1.540
Br4	0.000	1.613	-0.124
Br5	0.000	-1.613	-0.124

	C1	H2	H3	Br4	Br5
C1		1.0821	1.0821	1.9282	1.9282
H2	1.0821		1.7906	2.4845	2.4845
H3	1.0821	1.7906		2.4845	2.4845
Br4	1.9282	2.4845	2.4845		3.2261
Br5	1.9282	2.4845	2.4845	3.2261

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	111.663	H2	C1	Br4	107.922
H2	C1	Br5	107.922	H3	C1	Br4	107.922
H3	C1	Br5	107.922	Br4	C1	Br5	113.553

All results from a given calculation for CH₂Br₂ (dibromomethane)

using model chemistry: CCSD/6-311+G(3df,2p)

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: CCSD/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₂Br₂ (dibromomethane)