# generated using pymatgen
data_Ti3Ga2PRu6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.26550919
_cell_length_b   6.01822910
_cell_length_c   12.74474334
_cell_angle_alpha   90.00001444
_cell_angle_beta   89.99904360
_cell_angle_gamma   90.00309598
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Ga2PRu6
_chemical_formula_sum   'Ti6 Ga4 P2 Ru12'
_cell_volume   327.16790328
_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
  Ti  Ti0  1  0.00003844  0.99999883  0.99896250  1.0
  Ti  Ti1  1  0.50001627  0.50000161  0.16770667  1.0
  Ti  Ti2  1  0.99998062  0.00000081  0.33435164  1.0
  Ti  Ti3  1  0.49994915  0.49999835  0.49964996  1.0
  Ti  Ti4  1  0.99997658  0.00000235  0.66701750  1.0
  Ti  Ti5  1  0.50001812  0.49999911  0.83230225  1.0
  Ga  Ga6  1  0.99998526  0.50000267  0.33265347  1.0
  Ga  Ga7  1  0.49995825  0.99999626  0.49956108  1.0
  Ga  Ga8  1  0.99998043  0.50000400  0.66708319  1.0
  Ga  Ga9  1  0.50006017  0.99999750  0.83403834  1.0
  P  P10  1  0.00001400  0.49999823  0.99865682  1.0
  P  P11  1  0.50005873  0.00000234  0.16802258  1.0
  Ru  Ru12  1  0.50004021  0.25210989  0.00494047  1.0
  Ru  Ru13  1  0.50001956  0.74788818  0.00494037  1.0
  Ru  Ru14  1  0.00000585  0.24790279  0.16173114  1.0
  Ru  Ru15  1  0.00002257  0.75209946  0.16173119  1.0
  Ru  Ru16  1  0.49992663  0.24498021  0.32595205  1.0
  Ru  Ru17  1  0.50004074  0.75502402  0.32595074  1.0
  Ru  Ru18  1  0.00014926  0.24900029  0.49844033  1.0
  Ru  Ru19  1  0.99974993  0.75100003  0.49844014  1.0
  Ru  Ru20  1  0.49977840  0.25098429  0.66821838  1.0
  Ru  Ru21  1  0.50017411  0.74901739  0.66821855  1.0
  Ru  Ru22  1  0.00008269  0.25502287  0.84071337  1.0
  Ru  Ru23  1  0.99996604  0.74497452  0.84071526  1.0