# generated using pymatgen
data_Sr4Ca(FeO3)5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.80891612
_cell_length_b   9.55685757
_cell_length_c   8.71594902
_cell_angle_alpha   89.97091585
_cell_angle_beta   90.01904968
_cell_angle_gamma   65.87878135
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr4Ca(FeO3)5
_chemical_formula_sum   'Sr8 Ca2 Fe10 O30'
_cell_volume   593.66347831
_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  0.40021600  0.19973500  0.39934200  1.0
  Sr  Sr1  1  0.90005100  0.19974200  0.39936100  1.0
  Sr  Sr2  1  0.30047400  0.39913700  0.80042900  1.0
  Sr  Sr3  1  0.80034100  0.39922200  0.80042000  1.0
  Sr  Sr4  1  0.19985600  0.60034300  0.19966900  1.0
  Sr  Sr5  1  0.69976900  0.60042000  0.19963600  1.0
  Sr  Sr6  1  0.09982200  0.80044600  0.60066800  1.0
  Sr  Sr7  1  0.59974000  0.80046800  0.60071800  1.0
  Ca  Ca8  1  0.49992000  0.00023700  0.99983100  1.0
  Ca  Ca9  1  0.99985900  0.00023800  0.99985100  1.0
  Fe  Fe10  1  0.99996300  0.49997900  0.50001800  1.0
  Fe  Fe11  1  0.49996900  0.50006100  0.50008800  1.0
  Fe  Fe12  1  0.89922400  0.70165900  0.90057800  1.0
  Fe  Fe13  1  0.39905500  0.70159400  0.90074900  1.0
  Fe  Fe14  1  0.79976500  0.90050900  0.29833400  1.0
  Fe  Fe15  1  0.29976400  0.90064500  0.29841400  1.0
  Fe  Fe16  1  0.20032000  0.09936200  0.70154500  1.0
  Fe  Fe17  1  0.70023000  0.09937600  0.70164200  1.0
  Fe  Fe18  1  0.10073700  0.29843500  0.09940600  1.0
  Fe  Fe19  1  0.60085400  0.29841800  0.09936700  1.0
  O  O20  1  0.24992200  0.50005400  0.50001700  1.0
  O  O21  1  0.75000500  0.50006900  0.50007500  1.0
  O  O22  1  0.24999100  0.00004100  0.49996200  1.0
  O  O23  1  0.75002800  0.99994100  0.49998600  1.0
  O  O24  1  0.00001500  0.49999000  0.99999100  1.0
  O  O25  1  0.50000400  0.49997800  0.99999400  1.0
  O  O26  1  0.14769900  0.70465200  0.90181900  1.0
  O  O27  1  0.64766000  0.70466600  0.90175800  1.0
  O  O28  1  0.04915500  0.90173200  0.29524200  1.0
  O  O29  1  0.54916600  0.90172200  0.29522500  1.0
  O  O30  1  0.45087100  0.09822100  0.70466900  1.0
  O  O31  1  0.95088700  0.09820700  0.70465000  1.0
  O  O32  1  0.35235200  0.29532300  0.09829800  1.0
  O  O33  1  0.85231400  0.29533400  0.09823400  1.0
  O  O34  1  0.05083400  0.39828600  0.29928800  1.0
  O  O35  1  0.55086400  0.39836400  0.29930300  1.0
  O  O36  1  0.94916500  0.60172500  0.70076200  1.0
  O  O37  1  0.44909100  0.60171500  0.70075600  1.0
  O  O38  1  0.89969600  0.70061100  0.39827700  1.0
  O  O39  1  0.39963500  0.70070800  0.39830300  1.0
  O  O40  1  0.10030800  0.29937800  0.60172000  1.0
  O  O41  1  0.60034400  0.29934500  0.60169600  1.0
  O  O42  1  0.84821500  0.80358100  0.09777600  1.0
  O  O43  1  0.34818800  0.80361900  0.09783400  1.0
  O  O44  1  0.15181800  0.19637300  0.90215300  1.0
  O  O45  1  0.65182300  0.19635600  0.90217000  1.0
  O  O46  1  0.79900800  0.90208300  0.80368300  1.0
  O  O47  1  0.29894600  0.90208600  0.80364400  1.0
  O  O48  1  0.20101600  0.09789800  0.19630500  1.0
  O  O49  1  0.70105200  0.09791800  0.19634200  1.0