# generated using pymatgen
data_Sr3Ca5Fe4(CoO6)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.68342682
_cell_length_b   7.68342682
_cell_length_c   7.66639317
_cell_angle_alpha   89.99136248
_cell_angle_beta   89.99136248
_cell_angle_gamma   89.96823582
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr3Ca5Fe4(CoO6)4
_chemical_formula_sum   'Sr3 Ca5 Fe4 Co4 O24'
_cell_volume   452.58580714
_cell_formula_units_Z   1
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  0.25028600  0.74972600  0.74895800  1.0
  Sr  Sr1  1  0.25027700  0.25027700  0.74892200  1.0
  Sr  Sr2  1  0.74972600  0.25028600  0.74895800  1.0
  Ca  Ca3  1  0.24967000  0.75029800  0.25059800  1.0
  Ca  Ca4  1  0.24966400  0.24966400  0.25055500  1.0
  Ca  Ca5  1  0.75038500  0.75038500  0.74928000  1.0
  Ca  Ca6  1  0.75034200  0.75034200  0.25060700  1.0
  Ca  Ca7  1  0.75029800  0.24967000  0.25059800  1.0
  Fe  Fe8  1  0.99937600  0.99937600  0.00175600  1.0
  Fe  Fe9  1  0.99926400  0.50050800  0.00175300  1.0
  Fe  Fe10  1  0.99935800  0.99935800  0.49852300  1.0
  Fe  Fe11  1  0.50050800  0.99926400  0.00175300  1.0
  Co  Co12  1  0.99920600  0.50067600  0.49798000  1.0
  Co  Co13  1  0.50054400  0.50054400  0.00270200  1.0
  Co  Co14  1  0.50067600  0.99920600  0.49798000  1.0
  Co  Co15  1  0.50077500  0.50077500  0.49824900  1.0
  O  O16  1  0.24913000  0.99941800  0.00547100  1.0
  O  O17  1  0.25639900  0.50064900  0.00635400  1.0
  O  O18  1  0.25195500  0.99935200  0.49383800  1.0
  O  O19  1  0.23906900  0.50058600  0.49454300  1.0
  O  O20  1  0.75081100  0.99754700  0.00366300  1.0
  O  O21  1  0.74344000  0.50240100  0.00405200  1.0
  O  O22  1  0.74797800  0.99752200  0.49616300  1.0
  O  O23  1  0.76059000  0.50256900  0.49630700  1.0
  O  O24  1  0.99751500  0.99751500  0.75217700  1.0
  O  O25  1  0.99738200  0.50292300  0.74753400  1.0
  O  O26  1  0.99931400  0.99931400  0.24802600  1.0
  O  O27  1  0.99923500  0.50051000  0.25282000  1.0
  O  O28  1  0.50292300  0.99738200  0.74753400  1.0
  O  O29  1  0.50297700  0.50297700  0.74048600  1.0
  O  O30  1  0.50051000  0.99923500  0.25282000  1.0
  O  O31  1  0.50037400  0.50037400  0.25865000  1.0
  O  O32  1  0.99754700  0.75081100  0.00366300  1.0
  O  O33  1  0.99941800  0.24913000  0.00547100  1.0
  O  O34  1  0.99752200  0.74797800  0.49616300  1.0
  O  O35  1  0.99935200  0.25195500  0.49383800  1.0
  O  O36  1  0.50240100  0.74344000  0.00405200  1.0
  O  O37  1  0.50064900  0.25639900  0.00635400  1.0
  O  O38  1  0.50256900  0.76059000  0.49630700  1.0
  O  O39  1  0.50058600  0.23906900  0.49454300  1.0