# generated using pymatgen
data_Th3Be2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.94638045
_cell_length_b   9.94638045
_cell_length_c   3.45381864
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Be2Ru5
_chemical_formula_sum   'Th6 Be4 Ru10'
_cell_volume   341.68795011
_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
  Th  Th0  1  0.82918160  0.67081840  0.00000000  1.0
  Th  Th1  1  0.17081840  0.32918160  0.00000000  1.0
  Th  Th2  1  0.32918160  0.82918160  0.00000000  1.0
  Th  Th3  1  0.67081840  0.17081840  0.00000000  1.0
  Th  Th4  1  0.50000000  0.50000000  0.00000000  1.0
  Th  Th5  1  0.00000000  0.00000000  0.00000000  1.0
  Be  Be6  1  0.62146409  0.87853591  0.00000000  1.0
  Be  Be7  1  0.37853591  0.12146409  0.00000000  1.0
  Be  Be8  1  0.12146409  0.62146409  0.00000000  1.0
  Be  Be9  1  0.87853591  0.37853591  0.00000000  1.0
  Ru  Ru10  1  0.57414564  0.71798244  0.50000000  1.0
  Ru  Ru11  1  0.42585436  0.28201756  0.50000000  1.0
  Ru  Ru12  1  0.07414564  0.78201756  0.50000000  1.0
  Ru  Ru13  1  0.92585436  0.21798244  0.50000000  1.0
  Ru  Ru14  1  0.28201756  0.57414564  0.50000000  1.0
  Ru  Ru15  1  0.71798244  0.42585436  0.50000000  1.0
  Ru  Ru16  1  0.21798244  0.07414564  0.50000000  1.0
  Ru  Ru17  1  0.78201756  0.92585436  0.50000000  1.0
  Ru  Ru18  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.50000000  0.50000000  1.0