# generated using pymatgen
data_Th2Si4(PRu4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.50237023
_cell_length_b   9.50236958
_cell_length_c   3.98918084
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999205
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Si4(PRu4)3
_chemical_formula_sum   'Th2 Si4 P3 Ru12'
_cell_volume   311.94516331
_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  0.66666700  0.33333300  0.50000000  1.0
  Th  Th1  1  0.33333300  0.66666700  0.00000000  1.0
  Si  Si2  1  0.61190559  0.71521230  0.50000000  1.0
  Si  Si3  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si4  1  0.28478770  0.89669329  0.50000000  1.0
  Si  Si5  1  0.10330671  0.38809441  0.50000000  1.0
  P  P6  1  0.89741854  0.58174417  0.00000000  1.0
  P  P7  1  0.41825583  0.31567337  0.00000000  1.0
  P  P8  1  0.68432663  0.10258146  0.00000000  1.0
  Ru  Ru9  1  0.56159454  0.95363037  0.50000000  1.0
  Ru  Ru10  1  0.39203583  0.43840546  0.50000000  1.0
  Ru  Ru11  1  0.90555985  0.10930962  0.50000000  1.0
  Ru  Ru12  1  0.20374977  0.09444015  0.50000000  1.0
  Ru  Ru13  1  0.89069038  0.79625023  0.50000000  1.0
  Ru  Ru14  1  0.72359826  0.88452086  0.00000000  1.0
  Ru  Ru15  1  0.11547914  0.83907539  0.00000000  1.0
  Ru  Ru16  1  0.16092461  0.27640174  0.00000000  1.0
  Ru  Ru17  1  0.42400420  0.07231807  0.00000000  1.0
  Ru  Ru18  1  0.92768193  0.35168713  0.00000000  1.0
  Ru  Ru19  1  0.64831287  0.57599580  0.00000000  1.0
  Ru  Ru20  1  0.04636963  0.60796417  0.50000000  1.0