# generated using pymatgen
data_Ti3ReSi3Ru2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.38805223
_cell_length_b   7.38805265
_cell_length_c   7.38805264
_cell_angle_alpha   126.93016082
_cell_angle_beta   124.87396709
_cell_angle_gamma   80.06015161
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3ReSi3Ru2
_chemical_formula_sum   'Ti6 Re2 Si6 Ru4'
_cell_volume   255.32440896
_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  0.24548685  0.90960441  0.16411656  1.0
  Ti  Ti1  1  0.96306934  0.48933778  0.02626644  1.0
  Ti  Ti2  1  0.03693066  0.06319709  0.52626644  1.0
  Ti  Ti3  1  0.44157977  0.48441215  0.54283238  1.0
  Ti  Ti4  1  0.75451315  0.91862971  0.66411656  1.0
  Ti  Ti5  1  0.55842023  0.10125260  0.04283238  1.0
  Re  Re6  1  0.50000000  0.24291292  0.74291292  1.0
  Re  Re7  1  1.00000000  0.24291292  0.24291292  1.0
  Si  Si8  1  0.77677627  0.54221662  0.26544136  1.0
  Si  Si9  1  0.17588099  0.16015688  0.99705228  1.0
  Si  Si10  1  0.66310461  0.16015688  0.48427489  1.0
  Si  Si11  1  0.33689539  0.82117028  0.49705228  1.0
  Si  Si12  1  0.22322373  0.48866509  0.76544136  1.0
  Si  Si13  1  0.82411901  0.82117028  0.98427489  1.0
  Ru  Ru14  1  0.83824484  0.49575934  0.59069168  1.0
  Ru  Ru15  1  0.59493333  0.75244684  0.09069168  1.0
  Ru  Ru16  1  0.40506667  0.49575934  0.15751451  1.0
  Ru  Ru17  1  0.16175516  0.75244684  0.65751451  1.0