# generated using pymatgen
data_LaTh3(Ga3Ir)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.64373444
_cell_length_b   7.64704671
_cell_length_c   9.47497184
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.66539160
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTh3(Ga3Ir)6
_chemical_formula_sum   'La1 Th3 Ga18 Ir6'
_cell_volume   481.24071840
_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
  La  La0  1  0.33000070  0.00275162  0.75000000  1.0
  Th  Th1  1  0.99837352  0.67075419  0.25000000  1.0
  Th  Th2  1  0.00152712  0.33026282  0.75000000  1.0
  Th  Th3  1  0.67025459  0.99743611  0.25000000  1.0
  Ga  Ga4  1  0.13530470  0.13442878  0.25000000  1.0
  Ga  Ga5  1  0.86640725  0.86687765  0.75000000  1.0
  Ga  Ga6  1  0.00603206  0.33523107  0.07876828  1.0
  Ga  Ga7  1  0.99585253  0.66686964  0.92209390  1.0
  Ga  Ga8  1  0.99585253  0.66686964  0.57790610  1.0
  Ga  Ga9  1  0.33543364  0.00597781  0.42303330  1.0
  Ga  Ga10  1  0.00603206  0.33523107  0.42123172  1.0
  Ga  Ga11  1  0.66296914  0.99408139  0.57792761  1.0
  Ga  Ga12  1  0.66296914  0.99408139  0.92207239  1.0
  Ga  Ga13  1  0.33543364  0.00597781  0.07696670  1.0
  Ga  Ga14  1  0.33723099  0.33589289  0.56234261  1.0
  Ga  Ga15  1  0.66206470  0.66186924  0.43764838  1.0
  Ga  Ga16  1  0.66206470  0.66186924  0.06235162  1.0
  Ga  Ga17  1  0.33723099  0.33589289  0.93765739  1.0
  Ga  Ga18  1  0.34043622  0.54222426  0.25000000  1.0
  Ga  Ga19  1  0.66012980  0.45685814  0.75000000  1.0
  Ga  Ga20  1  0.54332936  0.33984915  0.25000000  1.0
  Ga  Ga21  1  0.45642586  0.65970376  0.75000000  1.0
  Ir  Ir22  1  0.67464190  0.32968891  0.00175785  1.0
  Ir  Ir23  1  0.32755924  0.67039405  0.00197756  1.0
  Ir  Ir24  1  0.32755924  0.67039405  0.49802244  1.0
  Ir  Ir25  1  0.67464190  0.32968891  0.49824215  1.0
  Ir  Ir26  1  0.99712123  0.99942226  0.00239569  1.0
  Ir  Ir27  1  0.99712123  0.99942226  0.49760431  1.0