# generated using pymatgen
data_Fe(ReO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.80180685
_cell_length_b   4.80184485
_cell_length_c   8.50878000
_cell_angle_alpha   89.99858856
_cell_angle_beta   89.99906940
_cell_angle_gamma   89.89943639
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe(ReO3)2
_chemical_formula_sum   'Fe2 Re4 O12'
_cell_volume   196.19116051
_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
  Fe  Fe0  1  0.99978700  0.00033500  0.66672500  1.0
  Fe  Fe1  1  0.50009400  0.49996100  0.16665000  1.0
  Re  Re2  1  0.49990300  0.49997900  0.51567600  1.0
  Re  Re3  1  0.49989600  0.49995600  0.81753500  1.0
  Re  Re4  1  0.00013100  0.00002300  0.01457200  1.0
  Re  Re5  1  0.00010300  0.99999000  0.31879200  1.0
  O  O6  1  0.21955100  0.78041200  0.16679800  1.0
  O  O7  1  0.78051400  0.21943600  0.16680300  1.0
  O  O8  1  0.27946800  0.27941000  0.66656000  1.0
  O  O9  1  0.72047700  0.72041900  0.66653800  1.0
  O  O10  1  0.20708400  0.79291700  0.49276400  1.0
  O  O11  1  0.20708900  0.79291200  0.84047900  1.0
  O  O12  1  0.79287800  0.20711100  0.49270700  1.0
  O  O13  1  0.79286700  0.20711700  0.84051700  1.0
  O  O14  1  0.29301900  0.29299800  0.34044600  1.0
  O  O15  1  0.29312900  0.29309100  0.99298400  1.0
  O  O16  1  0.70707500  0.70704800  0.34050200  1.0
  O  O17  1  0.70693600  0.70688500  0.99295100  1.0