# generated using pymatgen
data_LiTi12Re5Ir6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38003352
_cell_length_b   6.18437582
_cell_length_c   13.14199699
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99948614
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTi12Re5Ir6
_chemical_formula_sum   'Li1 Ti12 Re5 Ir6'
_cell_volume   355.98743614
_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
  Li  Li0  1  0.99999676  0.00000000  0.00000745  1.0
  Ti  Ti1  1  0.49999722  0.24966130  0.00002762  1.0
  Ti  Ti2  1  0.49999722  0.75034070  0.00002762  1.0
  Ti  Ti3  1  0.00005030  0.24975680  0.16739179  1.0
  Ti  Ti4  1  0.00005030  0.75024320  0.16739179  1.0
  Ti  Ti5  1  0.50004980  0.24972430  0.33340928  1.0
  Ti  Ti6  1  0.50004980  0.75027370  0.33340928  1.0
  Ti  Ti7  1  0.00000072  0.24963754  0.49997328  1.0
  Ti  Ti8  1  0.00000072  0.75036246  0.49997328  1.0
  Ti  Ti9  1  0.49995206  0.24972136  0.66656517  1.0
  Ti  Ti10  1  0.49995206  0.75027664  0.66656517  1.0
  Ti  Ti11  1  0.99994812  0.24975700  0.83264114  1.0
  Ti  Ti12  1  0.99994812  0.75024300  0.83264114  1.0
  Re  Re13  1  0.50004113  0.49999900  0.16621255  1.0
  Re  Re14  1  0.00004676  0.00000000  0.33321757  1.0
  Re  Re15  1  0.50000024  0.49999900  0.49995595  1.0
  Re  Re16  1  0.99995333  0.00000000  0.66674166  1.0
  Re  Re17  1  0.49995901  0.49999900  0.83383748  1.0
  Ir  Ir18  1  0.99999934  0.49999900  0.00002341  1.0
  Ir  Ir19  1  0.50005793  0.00000000  0.16402895  1.0
  Ir  Ir20  1  0.00004454  0.49999900  0.33255858  1.0
  Ir  Ir21  1  0.50000241  0.00000000  0.49997829  1.0
  Ir  Ir22  1  0.99995644  0.49999900  0.66742153  1.0
  Ir  Ir23  1  0.49994166  0.00000000  0.83600003  1.0