# generated using pymatgen
data_LuTh3(AlRu)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.04679927
_cell_length_b   7.01220413
_cell_length_c   8.31375931
_cell_angle_alpha   90.14912074
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuTh3(AlRu)4
_chemical_formula_sum   'Lu1 Th3 Al4 Ru4'
_cell_volume   235.91860383
_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
  Lu  Lu0  1  0.75000000  0.54312489  0.81828412  1.0
  Th  Th1  1  0.25000000  0.96448004  0.31499674  1.0
  Th  Th2  1  0.25000000  0.46513610  0.17875205  1.0
  Th  Th3  1  0.75000000  0.03764790  0.68583310  1.0
  Al  Al4  1  0.25000000  0.37849374  0.56248626  1.0
  Al  Al5  1  0.25000000  0.86067728  0.94086377  1.0
  Al  Al6  1  0.75000000  0.62589743  0.45168052  1.0
  Al  Al7  1  0.75000000  0.12892552  0.05101932  1.0
  Ru  Ru8  1  0.25000000  0.23749595  0.87195441  1.0
  Ru  Ru9  1  0.25000000  0.74292169  0.62652162  1.0
  Ru  Ru10  1  0.75000000  0.75734667  0.12780877  1.0
  Ru  Ru11  1  0.75000000  0.25785177  0.36980133  1.0