data_comp_carborone_2003776_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   Se1   Se1   Se    3.42991   -0.249793   14.9802   
LIG   B3   B3   B     3.05291   1.40813   16.3468   
LIG   B4   B4   B     2.0188   -0.138208   16.5927   
LIG   B5   B5   B     3.1624   -1.68533   16.5375   
LIG   B6   B6   B     4.95868   -1.14439   16.2142   
LIG   B7   B7   B     4.23365   1.4092   17.6661   
LIG   B8   B8   B     2.5795   0.818152   17.9466   
LIG   B9   B9   B     2.60333   -0.965118   18.035   
LIG   B10   B10   B     4.29286   -1.49981   17.8499   
LIG   B11   B11   B     5.32987   -0.0757283   17.5971   
LIG   B12   B12   B     3.94541   0.000639785   18.7285   
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
LIG   Se1   B3   SINGLE      
LIG   Se1   B4   SINGLE      
LIG   Se1   B5   SINGLE      
LIG   Se1   B6   SINGLE      
LIG   B3   B4   SINGLE      
LIG   B3   B7   SINGLE      
LIG   B3   B8   SINGLE      
LIG   B4   B5   SINGLE      
LIG   B4   B8   SINGLE      
LIG   B4   B9   SINGLE      
LIG   B5   B6   SINGLE      
LIG   B5   B9   SINGLE      
LIG   B5   B10   SINGLE      
LIG   B6   B10   SINGLE      
LIG   B6   B11   SINGLE      
LIG   B7   B8   SINGLE      
LIG   B7   B11   SINGLE      
LIG   B7   B12   SINGLE      
LIG   B8   B9   SINGLE      
LIG   B8   B12   SINGLE      
LIG   B9   B10   SINGLE      
LIG   B9   B12   SINGLE      
LIG   B10   B11   SINGLE      
LIG   B10   B12   SINGLE      
LIG   B11   B12   SINGLE      
