data_comp_carborone_7000843_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     -1.79841   4.00553   9.23128   
LIG   B3   B3   B     -2.26838   2.54559   9.37108   
LIG   B5   B5   B     -3.5425   3.88867   8.96198   
LIG   C6   C6   C     -3.04253   4.9777   11.5431   
LIG   B7   B7   B     -2.79665   2.02732   11.0634   
LIG   B8   B8   B     -3.95229   2.23226   9.76399   
LIG   B9   B9   B     -4.10447   5.15892   10.2629   
LIG   B10   B10   B     -3.03562   3.43138   12.17   
LIG   B11   B11   B     -4.93585   3.6397   10.0907   
LIG   B12   B12   B     -4.54447   4.29345   11.7065   
LIG   B13   B13   B     -4.41899   2.55575   11.4269   
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   B3   SINGLE      
LIG   C1   B5   SINGLE      
LIG   B3   B5   SINGLE      
LIG   B3   B7   SINGLE      
LIG   B3   B8   SINGLE      
LIG   B5   B8   SINGLE      
LIG   B5   B9   SINGLE      
LIG   B5   B11   SINGLE      
LIG   C6   B9   SINGLE      
LIG   C6   B10   SINGLE      
LIG   C6   B12   SINGLE      
LIG   B7   B8   SINGLE      
LIG   B7   B10   SINGLE      
LIG   B7   B13   SINGLE      
LIG   B8   B11   SINGLE      
LIG   B8   B13   SINGLE      
LIG   B9   B11   SINGLE      
LIG   B9   B12   SINGLE      
LIG   B10   B12   SINGLE      
LIG   B10   B13   SINGLE      
LIG   B11   B12   SINGLE      
LIG   B11   B13   SINGLE      
LIG   B12   B13   SINGLE      
