# generated using pymatgen
data_Sr3Ca(FeO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.50814616
_cell_length_b   5.50799908
_cell_length_c   7.78812000
_cell_angle_alpha   89.99979193
_cell_angle_beta   89.99979194
_cell_angle_gamma   89.99660179
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr3Ca(FeO3)4
_chemical_formula_sum   'Sr3 Ca1 Fe4 O12'
_cell_volume   236.28271304
_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  0.50000000  0.00000000  0.25001500  1.0
  Sr  Sr1  1  0.00000000  0.50000000  0.25001500  1.0
  Sr  Sr2  1  0.00000000  0.50000000  0.74998500  1.0
  Ca  Ca3  1  0.50000000  0.00000000  0.74998600  1.0
  Fe  Fe4  1  0.00000000  0.00000000  0.99857000  1.0
  Fe  Fe5  1  0.50000000  0.50000000  0.99858600  1.0
  Fe  Fe6  1  0.00000100  0.00000000  0.50141400  1.0
  Fe  Fe7  1  0.49999900  0.50000000  0.50143300  1.0
  O  O8  1  0.25253400  0.24746700  0.99668000  1.0
  O  O9  1  0.74746500  0.75253300  0.99668000  1.0
  O  O10  1  0.25253200  0.24746400  0.50332000  1.0
  O  O11  1  0.74746800  0.75253600  0.50331900  1.0
  O  O12  1  0.99999900  0.00000000  0.24999800  1.0
  O  O13  1  0.50000000  0.50000000  0.24999600  1.0
  O  O14  1  0.00000000  0.00000000  0.75000100  1.0
  O  O15  1  0.50000000  0.50000000  0.75000400  1.0
  O  O16  1  0.25253600  0.75253200  0.99667800  1.0
  O  O17  1  0.74746500  0.24746900  0.99668000  1.0
  O  O18  1  0.25253100  0.75253800  0.50331900  1.0
  O  O19  1  0.74746900  0.24746300  0.50332100  1.0