# generated using pymatgen
data_LuSi7Ir3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.97872357
_cell_length_b   7.97872378
_cell_length_c   7.97872386
_cell_angle_alpha   56.56567760
_cell_angle_beta   56.56567710
_cell_angle_gamma   56.56567502
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuSi7Ir3
_chemical_formula_sum   'Lu2 Si14 Ir6'
_cell_volume   330.65691757
_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
  Lu  Lu0  1  0.00000000  0.00000000  0.00000000  1.0
  Lu  Lu1  1  0.50000000  0.50000000  0.50000000  1.0
  Si  Si2  1  0.75000000  0.75000000  0.75000000  1.0
  Si  Si3  1  0.25000000  0.25000000  0.25000000  1.0
  Si  Si4  1  0.85032126  0.06260708  0.67352036  1.0
  Si  Si5  1  0.67352036  0.85032126  0.06260708  1.0
  Si  Si6  1  0.06260708  0.67352036  0.85032126  1.0
  Si  Si7  1  0.64967874  0.82647964  0.43739292  1.0
  Si  Si8  1  0.43739292  0.64967874  0.82647964  1.0
  Si  Si9  1  0.82647964  0.43739292  0.64967874  1.0
  Si  Si10  1  0.17352036  0.56260708  0.35032126  1.0
  Si  Si11  1  0.56260708  0.35032126  0.17352036  1.0
  Si  Si12  1  0.35032126  0.17352036  0.56260708  1.0
  Si  Si13  1  0.93739292  0.32647964  0.14967874  1.0
  Si  Si14  1  0.32647964  0.14967874  0.93739292  1.0
  Si  Si15  1  0.14967874  0.93739292  0.32647964  1.0
  Ir  Ir16  1  0.07260076  0.42739924  0.75000000  1.0
  Ir  Ir17  1  0.25000000  0.92739924  0.57260076  1.0
  Ir  Ir18  1  0.57260076  0.25000000  0.92739924  1.0
  Ir  Ir19  1  0.92739924  0.57260076  0.25000000  1.0
  Ir  Ir20  1  0.42739924  0.75000000  0.07260076  1.0
  Ir  Ir21  1  0.75000000  0.07260076  0.42739924  1.0