data_comp_carborone_7029328_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   C2   C2   C     5.68753   5.752   18.151   
LIG   C3   C3   C     5.14491   6.01811   16.7071   
LIG   B4   B4   B     3.56242   5.81853   16.2703   
LIG   B5   B5   B     2.3198   5.46543   17.5062   
LIG   B6   B6   B     2.92428   5.16094   19.1634   
LIG   B7   B7   B     4.71627   5.25689   19.3968   
LIG   B8   B8   B     5.54298   7.37935   17.6558   
LIG   B9   B9   B     4.25464   7.43436   16.5238   
LIG   B10   B10   B     2.65581   7.12859   17.0488   
LIG   B11   B11   B     2.32661   6.73711   18.7142   
LIG   B12   B12   B     3.6658   6.59382   19.8378   
LIG   B13   B13   B     5.26375   6.94053   19.2897   
LIG   B14   B14   B     3.84681   7.83736   18.3614   
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
LIG   C2   C3   SINGLE      
LIG   C2   B7   SINGLE      
LIG   C2   B8   SINGLE      
LIG   C2   B13   SINGLE      
LIG   C3   B4   SINGLE      
LIG   C3   B8   SINGLE      
LIG   C3   B9   SINGLE      
LIG   B4   B5   SINGLE      
LIG   B4   B9   SINGLE      
LIG   B4   B10   SINGLE      
LIG   B5   B6   SINGLE      
LIG   B5   B10   SINGLE      
LIG   B5   B11   SINGLE      
LIG   B6   B7   SINGLE      
LIG   B6   B11   SINGLE      
LIG   B6   B12   SINGLE      
LIG   B7   B12   SINGLE      
LIG   B7   B13   SINGLE      
LIG   B8   B9   SINGLE      
LIG   B8   B13   SINGLE      
LIG   B8   B14   SINGLE      
LIG   B9   B10   SINGLE      
LIG   B9   B14   SINGLE      
LIG   B10   B11   SINGLE      
LIG   B10   B14   SINGLE      
LIG   B11   B12   SINGLE      
LIG   B11   B14   SINGLE      
LIG   B12   B13   SINGLE      
LIG   B12   B14   SINGLE      
LIG   B13   B14   SINGLE      
