data_comp_carborone_7003437_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   C1B   C1B   C     7.51015   6.85361   19.3873   
LIG   B2B   B2B   B     7.99581   5.48263   19.8435   
LIG   B5B   B5B   B     8.41311   6.24302   18.0093   
LIG   B9B   B9B   B     9.34345   4.80897   18.854   
LIG   C10B   C10B   C     10.6775   6.73768   20.2471   
LIG   B11B   B11B   B     10.1368   5.8736   17.7107   
LIG   B12B   B12B   B     10.9475   5.38412   19.2228   
LIG   B13B   B13B   B     11.1745   7.00663   18.6225   
LIG   Co4   Co4   Co    8.73721   7.31516   21.0056   
LIG   C1A   C1A   C     8.18138   6.24377   22.7116   
LIG   B2A   B2A   B     6.88458   6.9386   22.2953   
LIG   B3A   B3A   B     9.49995   6.91345   23.0943   
LIG   B5A   B5A   B     7.76105   7.29789   24.056   
LIG   B6A   B6A   B     7.03787   8.62126   21.5634   
LIG   B7A   B7A   B     9.81384   8.59168   22.4447   
LIG   B8A   B8A   B     9.30915   8.38534   24.1197   
LIG   B9A   B9A   B     6.48223   8.42011   23.2222   
LIG   C10A   C10A   C     8.53048   9.36625   21.6974   
LIG   B11A   B11A   B     7.70674   9.07823   24.2908   
LIG   B12A   B12A   B     7.28896   9.89275   22.7564   
LIG   B13A   B13A   B     8.95355   9.8757   23.2894   
LIG   B3B   B3B   B     8.36859   8.02621   18.9012   
LIG   B6B   B6B   B     9.71472   5.39148   20.476   
LIG   B7B   B7B   B     10.0986   8.11001   19.4751   
LIG   B8B   B8B   B     9.74081   7.58471   17.8316   
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
LIG   C1B   B2B   SINGLE      
LIG   C1B   B5B   SINGLE      
LIG   C1B   Co4   SINGLE      
LIG   C1B   B3B   SINGLE      
LIG   B2B   B9B   SINGLE      
LIG   B2B   Co4   SINGLE      
LIG   B2B   B6B   SINGLE      
LIG   B5B   B9B   SINGLE      
LIG   B5B   B11B   SINGLE      
LIG   B5B   B8B   SINGLE      
LIG   B9B   B11B   SINGLE      
LIG   B9B   B12B   SINGLE      
LIG   B9B   B6B   SINGLE      
LIG   C10B   B12B   SINGLE      
LIG   C10B   B13B   SINGLE      
LIG   C10B   Co4   SINGLE      
LIG   C10B   B6B   SINGLE      
LIG   C10B   B7B   SINGLE      
LIG   B11B   B12B   SINGLE      
LIG   B11B   B13B   SINGLE      
LIG   B11B   B8B   SINGLE      
LIG   B12B   B13B   SINGLE      
LIG   B12B   B6B   SINGLE      
LIG   B13B   B7B   SINGLE      
LIG   B13B   B8B   SINGLE      
LIG   Co4   C1A   SINGLE      
LIG   Co4   B2A   SINGLE      
LIG   Co4   B3A   SINGLE      
LIG   Co4   B6A   SINGLE      
LIG   Co4   B7A   SINGLE      
LIG   Co4   C10A   SINGLE      
LIG   Co4   B3B   SINGLE      
LIG   Co4   B6B   SINGLE      
LIG   Co4   B7B   SINGLE      
LIG   C1A   B2A   SINGLE      
LIG   C1A   B3A   SINGLE      
LIG   C1A   B5A   SINGLE      
LIG   B2A   B6A   SINGLE      
LIG   B2A   B9A   SINGLE      
LIG   B3A   B7A   SINGLE      
LIG   B3A   B8A   SINGLE      
LIG   B5A   B8A   SINGLE      
LIG   B5A   B9A   SINGLE      
LIG   B5A   B11A   SINGLE      
LIG   B6A   B9A   SINGLE      
LIG   B6A   C10A   SINGLE      
LIG   B6A   B12A   SINGLE      
LIG   B7A   B8A   SINGLE      
LIG   B7A   C10A   SINGLE      
LIG   B7A   B13A   SINGLE      
LIG   B8A   B11A   SINGLE      
LIG   B8A   B13A   SINGLE      
LIG   B9A   B11A   SINGLE      
LIG   B9A   B12A   SINGLE      
LIG   C10A   B12A   SINGLE      
LIG   C10A   B13A   SINGLE      
LIG   B11A   B12A   SINGLE      
LIG   B11A   B13A   SINGLE      
LIG   B12A   B13A   SINGLE      
LIG   B3B   B7B   SINGLE      
LIG   B3B   B8B   SINGLE      
LIG   B7B   B8B   SINGLE      
