# generated using pymatgen
data_Th2Si2P5Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.47280718
_cell_length_b   9.43681326
_cell_length_c   3.96804226
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.68962881
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Si2P5Ru12
_chemical_formula_sum   'Th2 Si2 P5 Ru12'
_cell_volume   308.14899757
_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
  Th  Th0  1  0.66691592  0.33644358  0.50000000  1.0
  Th  Th1  1  0.33369881  0.66569225  0.00000000  1.0
  Si  Si2  1  0.61035183  0.71623242  0.50000000  1.0
  Si  Si3  1  0.00001613  0.99710052  0.00000000  1.0
  P  P4  1  0.28414020  0.89246496  0.50000000  1.0
  P  P5  1  0.10621469  0.38804946  0.50000000  1.0
  P  P6  1  0.89540998  0.58483777  0.00000000  1.0
  P  P7  1  0.41755943  0.31549448  0.00000000  1.0
  P  P8  1  0.68532607  0.10610173  0.00000000  1.0
  Ru  Ru9  1  0.55558264  0.95237027  0.50000000  1.0
  Ru  Ru10  1  0.38768465  0.43740115  0.50000000  1.0
  Ru  Ru11  1  0.90851295  0.11713823  0.50000000  1.0
  Ru  Ru12  1  0.20408911  0.08673424  0.50000000  1.0
  Ru  Ru13  1  0.88949601  0.79251747  0.50000000  1.0
  Ru  Ru14  1  0.72527984  0.88847976  0.00000000  1.0
  Ru  Ru15  1  0.11937898  0.83720760  0.00000000  1.0
  Ru  Ru16  1  0.15899524  0.27531082  0.00000000  1.0
  Ru  Ru17  1  0.42552958  0.07352596  0.00000000  1.0
  Ru  Ru18  1  0.92788884  0.35514961  0.00000000  1.0
  Ru  Ru19  1  0.64458763  0.57563840  0.00000000  1.0
  Ru  Ru20  1  0.05334148  0.60610632  0.50000000  1.0