# generated using pymatgen
data_Ti3P4Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.75806729
_cell_length_b   6.18572957
_cell_length_c   6.97419461
_cell_angle_alpha   89.59429326
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3P4Ru5
_chemical_formula_sum   'Ti3 P4 Ru5'
_cell_volume   162.12076922
_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
  Ti  Ti0  1  0.75000000  0.02401689  0.67645698  1.0
  Ti  Ti1  1  0.25000000  0.97836999  0.32220795  1.0
  Ti  Ti2  1  0.75000000  0.52629156  0.83194345  1.0
  P  P3  1  0.25000000  0.73304215  0.62136003  1.0
  P  P4  1  0.75000000  0.27454922  0.37231488  1.0
  P  P5  1  0.25000000  0.23352043  0.88324494  1.0
  P  P6  1  0.75000000  0.76987177  0.12665102  1.0
  Ru  Ru7  1  0.25000000  0.46561432  0.16577108  1.0
  Ru  Ru8  1  0.25000000  0.34922854  0.56090393  1.0
  Ru  Ru9  1  0.75000000  0.64781160  0.43634408  1.0
  Ru  Ru10  1  0.25000000  0.84954822  0.93901241  1.0
  Ru  Ru11  1  0.75000000  0.14813631  0.06378726  1.0