data_comp_carborone_4307914_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   C1   C1   C     6.04137   1.99006   14.9918   
LIG   C9   C9   C     4.04552   3.37364   16.1147   
LIG   B2   B2   B     5.15982   3.23715   14.8338   
LIG   B3   B3   B     5.74461   0.590969   15.5644   
LIG   B5   B5   B     5.58314   2.37939   16.5906   
LIG   B6   B6   B     3.32544   2.89125   14.6516   
LIG   B7   B7   B     4.0077   0.11323   15.5923   
LIG   B8   B8   B     4.73068   0.736773   17.0628   
LIG   B10   B10   B     2.76684   1.2626   15.0345   
LIG   B11   B11   B     3.94515   2.26616   17.4012   
LIG   B12   B12   B     2.601   2.56087   16.2169   
LIG   B13   B13   B     2.98068   0.88878   16.7802   
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
LIG   C1   B2   SINGLE      
LIG   C1   B3   SINGLE      
LIG   C1   B5   SINGLE      
LIG   C9   B2   SINGLE      
LIG   C9   B5   SINGLE      
LIG   C9   B6   SINGLE      
LIG   C9   B11   SINGLE      
LIG   C9   B12   SINGLE      
LIG   B2   B6   SINGLE      
LIG   B3   B7   SINGLE      
LIG   B3   B8   SINGLE      
LIG   B5   B8   SINGLE      
LIG   B5   B11   SINGLE      
LIG   B6   B10   SINGLE      
LIG   B6   B12   SINGLE      
LIG   B7   B8   SINGLE      
LIG   B7   B10   SINGLE      
LIG   B7   B13   SINGLE      
LIG   B8   B11   SINGLE      
LIG   B8   B13   SINGLE      
LIG   B10   B12   SINGLE      
LIG   B10   B13   SINGLE      
LIG   B11   B12   SINGLE      
LIG   B11   B13   SINGLE      
LIG   B12   B13   SINGLE      
