data_comp_carborone_4075406_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   C32   C1   C     11.3865   10.8604   0.0755685   
LIG   Tb2   Tb   Tb    8.97988   9.83884   0.863941   
LIG   B8   B3   B     6.64892   11.2228   1.15443   
LIG   B7   B6   B     5.04651   10.5517   0.692979   
LIG   Tb1   Tb   Tb    6.98612   13.0252   -0.863941   
LIG   C21   C2   C     10.5445   10.6923   -1.16729   
LIG   B6   B3   B     9.31708   11.6412   -1.15443   
LIG   B5   B4   B     9.40494   12.5158   0.257255   
LIG   B4   B5   B     10.7448   11.9121   1.02259   
LIG   B3   B6   B     10.9195   12.3123   -0.692979   
LIG   C8   C1   C     4.57948   12.0036   -0.0755685   
LIG   C7   C2   C     5.42151   12.1717   1.16729   
LIG   B2   B4   B     6.56106   10.3482   -0.257255   
LIG   B1   B5   B     5.22118   10.9519   -1.02259   
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
LIG   C32   Tb2   SINGLE      
LIG   C32   C21   SINGLE      
LIG   C32   B4   SINGLE      
LIG   C32   B3   SINGLE      
LIG   Tb2   B8   SINGLE      
LIG   Tb2   C21   SINGLE      
LIG   Tb2   B6   SINGLE      
LIG   Tb2   B5   SINGLE      
LIG   Tb2   B4   SINGLE      
LIG   Tb2   B2   SINGLE      
LIG   B8   B7   SINGLE      
LIG   B8   Tb1   SINGLE      
LIG   B8   C7   SINGLE      
LIG   B8   B2   SINGLE      
LIG   B7   C8   SINGLE      
LIG   B7   C7   SINGLE      
LIG   B7   B2   SINGLE      
LIG   B7   B1   SINGLE      
LIG   Tb1   B6   SINGLE      
LIG   Tb1   B5   SINGLE      
LIG   Tb1   C8   SINGLE      
LIG   Tb1   C7   SINGLE      
LIG   Tb1   B2   SINGLE      
LIG   Tb1   B1   SINGLE      
LIG   C21   B6   SINGLE      
LIG   C21   B3   SINGLE      
LIG   B6   B5   SINGLE      
LIG   B6   B3   SINGLE      
LIG   B5   B4   SINGLE      
LIG   B5   B3   SINGLE      
LIG   B4   B3   SINGLE      
LIG   C8   C7   SINGLE      
LIG   C8   B1   SINGLE      
LIG   B2   B1   SINGLE      
