# generated using pymatgen
data_La4(ThIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47735389
_cell_length_b   10.16369875
_cell_length_c   10.16369787
_cell_angle_alpha   120.87757817
_cell_angle_beta   90.43086364
_cell_angle_gamma   89.56913448
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La4(ThIr)3
_chemical_formula_sum   'La8 Th6 Ir6'
_cell_volume   574.25757945
_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
  La  La0  1  0.74562866  0.25143442  0.12529097  1.0
  La  La1  1  0.74562866  0.87470903  0.74856558  1.0
  La  La2  1  0.43888881  0.53635617  0.46364383  1.0
  La  La3  1  0.44378502  0.92665664  0.46180307  1.0
  La  La4  1  0.44378502  0.53819693  0.07334336  1.0
  La  La5  1  0.93800359  0.46195995  0.53804005  1.0
  La  La6  1  0.93918613  0.07372752  0.53751627  1.0
  La  La7  1  0.93918613  0.46248373  0.92627248  1.0
  Th  Th8  1  0.46715271  0.33428009  0.66571991  1.0
  Th  Th9  1  0.97935152  0.66710912  0.33289088  1.0
  Th  Th10  1  0.25381520  0.12572129  0.87427871  1.0
  Th  Th11  1  0.25156680  0.74868437  0.87425510  1.0
  Th  Th12  1  0.25156680  0.12574490  0.25131563  1.0
  Th  Th13  1  0.75067074  0.87212981  0.12787019  1.0
  Ir  Ir14  1  0.18472139  0.81501715  0.18498285  1.0
  Ir  Ir15  1  0.19684004  0.37097045  0.18363226  1.0
  Ir  Ir16  1  0.19684004  0.81636774  0.62902955  1.0
  Ir  Ir17  1  0.67177222  0.19116356  0.80883644  1.0
  Ir  Ir18  1  0.68180475  0.62662052  0.81933438  1.0
  Ir  Ir19  1  0.68180475  0.18066562  0.37337948  1.0