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	hartrees
Energy at 0K	-5184.642294
Energy at 298.15K
HF Energy	-5183.964419
Nuclear repulsion energy	353.666279

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	1.606	-0.124
Br5	0.000	-1.606	-0.124

	C1	H2	H3	Br4	Br5
C1		1.0808	1.0808	1.9205	1.9205
H2	1.0808		1.7897	2.4766	2.4766
H3	1.0808	1.7897		2.4766	2.4766
Br4	1.9205	2.4766	2.4766		3.2115
Br5	1.9205	2.4766	2.4766	3.2115

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	111.775	H2	C1	Br4	107.917
H2	C1	Br5	107.917	H3	C1	Br4	107.917
H3	C1	Br5	107.917	Br4	C1	Br5	113.463

All results from a given calculation for CH₂Br₂ (dibromomethane)

using model chemistry: CCSD/daug-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: CCSD/daug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂Br₂ (dibromomethane)