data_comp_carborone_4109214_1
_chem_comp.pdbx_type        HETAIN
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.orig_atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.model_Cartn_x
_chem_comp_atom.model_Cartn_y
_chem_comp_atom.model_Cartn_z
LIG   B1   B1   B     5.89857   -1.69887   -3.58897   
LIG   B2   B2   B     5.84235   -0.534004   -4.89838   
LIG   B3   B3   B     4.33595   -1.09932   -4.2272   
LIG   B4   B4   B     4.55234   -1.33061   -2.48458   
LIG   B5   B5   B     6.20224   -0.901688   -2.03672   
LIG   B6   B6   B     6.93084   -0.241784   -3.52429   
LIG   C7   C7   C     4.58733   0.495239   -4.57499   
LIG   B8   B8   B     3.95586   0.276972   -3.09962   
LIG   C9   C9   C     4.92288   0.116684   -1.78655   
LIG   B10   B10   B     6.15025   0.902975   -2.36743   
LIG   B11   B11   B     5.96452   1.14231   -4.12469   
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
LIG   B1   B2   SINGLE      
LIG   B1   B3   SINGLE      
LIG   B1   B4   SINGLE      
LIG   B1   B5   SINGLE      
LIG   B1   B6   SINGLE      
LIG   B2   B3   SINGLE      
LIG   B2   B6   SINGLE      
LIG   B2   C7   SINGLE      
LIG   B2   B11   SINGLE      
LIG   B3   B4   SINGLE      
LIG   B3   C7   SINGLE      
LIG   B3   B8   SINGLE      
LIG   B4   B5   SINGLE      
LIG   B4   B8   SINGLE      
LIG   B4   C9   SINGLE      
LIG   B5   B6   SINGLE      
LIG   B5   C9   SINGLE      
LIG   B5   B10   SINGLE      
LIG   B6   B10   SINGLE      
LIG   B6   B11   SINGLE      
LIG   C7   B8   SINGLE      
LIG   C7   B11   SINGLE      
LIG   B8   C9   SINGLE      
LIG   C9   B10   SINGLE      
LIG   B10   B11   SINGLE      
