# generated using pymatgen
data_Sr2FeClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.62090423
_cell_length_b   5.62055775
_cell_length_c   14.46140100
_cell_angle_alpha   90.00001300
_cell_angle_beta   89.99998701
_cell_angle_gamma   90.00053339
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2FeClO3
_chemical_formula_sum   'Sr8 Fe4 Cl4 O12'
_cell_volume   456.87350104
_cell_formula_units_Z   4
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  0.24999900  0.00000100  0.34400000  1.0
  Sr  Sr1  1  0.74999800  0.50000100  0.34400100  1.0
  Sr  Sr2  1  0.75000300  0.00000100  0.65600300  1.0
  Sr  Sr3  1  0.25000400  0.50000100  0.65600200  1.0
  Sr  Sr4  1  0.24999800  0.00000000  0.09574100  1.0
  Sr  Sr5  1  0.74999900  0.50000000  0.09574600  1.0
  Sr  Sr6  1  0.75000100  0.00000200  0.90425700  1.0
  Sr  Sr7  1  0.25000100  0.50000200  0.90425200  1.0
  Fe  Fe8  1  0.24999600  0.49999900  0.20763700  1.0
  Fe  Fe9  1  0.75000000  0.50000000  0.79236600  1.0
  Fe  Fe10  1  0.74999800  0.00000000  0.20760000  1.0
  Fe  Fe11  1  0.25000000  0.99999900  0.79236300  1.0
  Cl  Cl12  1  0.75000100  0.00000100  0.42432900  1.0
  Cl  Cl13  1  0.25000100  0.50000100  0.42433000  1.0
  Cl  Cl14  1  0.25000200  0.00000000  0.57568000  1.0
  Cl  Cl15  1  0.75000400  0.50000000  0.57567900  1.0
  O  O16  1  0.24999900  0.99999700  0.92521200  1.0
  O  O17  1  0.74999900  0.49999700  0.92524100  1.0
  O  O18  1  0.74999900  0.00000000  0.07479000  1.0
  O  O19  1  0.24999900  0.50000000  0.07475700  1.0
  O  O20  1  0.50000100  0.24999700  0.23087800  1.0
  O  O21  1  0.99999700  0.75000200  0.23087800  1.0
  O  O22  1  0.49999900  0.24999800  0.76912100  1.0
  O  O23  1  0.00000200  0.75000200  0.76912100  1.0
  O  O24  1  0.50000100  0.75000100  0.23088100  1.0
  O  O25  1  0.99999800  0.24999600  0.23088100  1.0
  O  O26  1  0.50000000  0.75000300  0.76912600  1.0
  O  O27  1  0.00000300  0.24999900  0.76912600  1.0