# generated using pymatgen
data_Y3ThZnRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.58417015
_cell_length_b   9.58417033
_cell_length_c   9.58416939
_cell_angle_alpha   59.99999982
_cell_angle_beta   59.99999920
_cell_angle_gamma   59.99999811
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y3ThZnRu
_chemical_formula_sum   'Y12 Th4 Zn4 Ru4'
_cell_volume   622.51312493
_cell_formula_units_Z   4
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
  Y  Y0  1  0.80861660  0.19138340  0.19138340  1.0
  Y  Y1  1  0.19138340  0.80861660  0.80861660  1.0
  Y  Y2  1  0.19138340  0.80861660  0.19138340  1.0
  Y  Y3  1  0.80861660  0.19138340  0.80861660  1.0
  Y  Y4  1  0.19138340  0.19138340  0.80861660  1.0
  Y  Y5  1  0.80861660  0.80861660  0.19138340  1.0
  Y  Y6  1  0.93672725  0.56327275  0.56327275  1.0
  Y  Y7  1  0.56327275  0.93672725  0.93672725  1.0
  Y  Y8  1  0.56327275  0.93672725  0.56327275  1.0
  Y  Y9  1  0.93672725  0.56327275  0.93672725  1.0
  Y  Y10  1  0.56327275  0.56327275  0.93672725  1.0
  Y  Y11  1  0.93672725  0.93672725  0.56327275  1.0
  Th  Th12  1  0.34991767  0.34991767  0.34991767  1.0
  Th  Th13  1  0.34991767  0.34991767  0.95024700  1.0
  Th  Th14  1  0.34991767  0.95024700  0.34991767  1.0
  Th  Th15  1  0.95024700  0.34991767  0.34991767  1.0
  Zn  Zn16  1  0.57695907  0.57695907  0.57695907  1.0
  Zn  Zn17  1  0.57695907  0.57695907  0.26912380  1.0
  Zn  Zn18  1  0.57695907  0.26912380  0.57695907  1.0
  Zn  Zn19  1  0.26912380  0.57695907  0.57695907  1.0
  Ru  Ru20  1  0.14392579  0.14392579  0.14392579  1.0
  Ru  Ru21  1  0.14392579  0.14392579  0.56822164  1.0
  Ru  Ru22  1  0.14392579  0.56822164  0.14392579  1.0
  Ru  Ru23  1  0.56822164  0.14392579  0.14392579  1.0