# generated using pymatgen
data_Sr3CaCo3CuO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.70581000
_cell_length_b   7.71041500
_cell_length_c   7.75498200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr3CaCo3CuO12
_chemical_formula_sum   'Sr6 Ca2 Co6 Cu2 O24'
_cell_volume   460.76220133
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Sr  Sr0  1  0.75077000  0.75038900  0.25000000  1.0
  Sr  Sr1  1  0.75054900  0.75058700  0.75000000  1.0
  Sr  Sr2  1  0.24940100  0.75079800  0.75000000  1.0
  Sr  Sr3  1  0.75054900  0.24941300  0.25000000  1.0
  Sr  Sr4  1  0.75077000  0.24961100  0.75000000  1.0
  Sr  Sr5  1  0.24940100  0.24920200  0.25000000  1.0
  Ca  Ca6  1  0.24833200  0.75094900  0.25000000  1.0
  Ca  Ca7  1  0.24833200  0.24905100  0.75000000  1.0
  Co  Co8  1  0.49817400  0.00000000  0.00000000  1.0
  Co  Co9  1  0.49817400  0.00000000  0.50000000  1.0
  Co  Co10  1  0.00144400  0.50000000  0.00000000  1.0
  Co  Co11  1  0.00144400  0.50000000  0.50000000  1.0
  Co  Co12  1  0.49833300  0.50000000  0.00000000  1.0
  Co  Co13  1  0.49833300  0.50000000  0.50000000  1.0
  Cu  Cu14  1  0.99992900  0.00000000  0.00000000  1.0
  Cu  Cu15  1  0.99992900  0.00000000  0.50000000  1.0
  O  O16  1  0.00388500  0.74321300  0.00287900  1.0
  O  O17  1  0.00388500  0.74321300  0.49712100  1.0
  O  O18  1  0.49609200  0.74708700  0.00197300  1.0
  O  O19  1  0.49609200  0.74708700  0.49802700  1.0
  O  O20  1  0.00388500  0.25678700  0.99712100  1.0
  O  O21  1  0.00388500  0.25678700  0.50287900  1.0
  O  O22  1  0.49609200  0.25291300  0.99802700  1.0
  O  O23  1  0.49609200  0.25291300  0.50197300  1.0
  O  O24  1  0.74237200  0.00000000  0.00000000  1.0
  O  O25  1  0.74237200  0.00000000  0.50000000  1.0
  O  O26  1  0.25671400  0.00000000  0.00000000  1.0
  O  O27  1  0.25671400  0.00000000  0.50000000  1.0
  O  O28  1  0.74812500  0.50000000  0.00000000  1.0
  O  O29  1  0.74812500  0.50000000  0.50000000  1.0
  O  O30  1  0.25232300  0.50000000  0.00000000  1.0
  O  O31  1  0.25232300  0.50000000  0.50000000  1.0
  O  O32  1  0.00606700  0.99575600  0.25000000  1.0
  O  O33  1  0.00606700  0.00424400  0.75000000  1.0
  O  O34  1  0.49607700  0.99675700  0.25000000  1.0
  O  O35  1  0.49607700  0.00324300  0.75000000  1.0
  O  O36  1  0.00456900  0.50188700  0.25000000  1.0
  O  O37  1  0.00456900  0.49811300  0.75000000  1.0
  O  O38  1  0.49686600  0.50082000  0.25000000  1.0
  O  O39  1  0.49686600  0.49918000  0.75000000  1.0