data_Te3Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.42
_cell_length_b   7.42
_cell_length_c   7.42
_cell_angle_alpha   100.44
_cell_angle_beta   100.44
_cell_angle_gamma   129.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te3Ru5
_chemical_formula_sum   'Te6 Ru10'
_cell_volume   284.8
_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
  Te  Te10  1  0.0  0.0  0.31  1.0
  Te  Te11  1  0.0  0.0  0.47  1.0
  Te  Te12  1  0.19  0.44  0.69  1.0
  Te  Te13  1  0.56  0.31  0.53  1.0
  Te  Te14  1  0.19  0.56  0.53  1.0
  Te  Te15  1  0.56  0.19  0.69  1.0
  Ru  Ru0  1  0.0  0.75  0.13  1.0
  Ru  Ru1  1  0.75  0.0  0.13  1.0
  Ru  Ru2  1  0.12  0.69  0.82  1.0
  Ru  Ru3  1  0.63  0.06  0.66  1.0
  Ru  Ru4  1  0.37  0.06  0.82  1.0
  Ru  Ru5  1  0.38  0.69  0.66  1.0
  Ru  Ru6  1  0.06  0.63  0.82  1.0
  Ru  Ru7  1  0.69  0.12  0.66  1.0
  Ru  Ru8  1  0.44  0.63  0.66  1.0
  Ru  Ru9  1  0.31  0.12  0.82  1.0

data_Te3Ru5
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.32
_cell_length_b   7.42
_cell_length_c   7.42
_cell_angle_alpha   79.56
_cell_angle_beta   64.8
_cell_angle_gamma   64.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te3Ru5
_chemical_formula_sum   'Te6 Ru10'
_cell_volume   284.8
_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
  Te  Te0  1  0.0  0.0  0.53  1.0
  Te  Te1  1  0.0  0.0  0.69  1.0
  Te  Te2  1  0.19  0.37  0.31  1.0
  Te  Te3  1  0.31  0.25  0.47  1.0
  Te  Te4  1  0.44  0.75  0.31  1.0
  Te  Te5  1  0.56  0.63  0.47  1.0
  Ru  Ru6  1  0.0  0.75  0.87  1.0
  Ru  Ru7  1  0.06  0.31  0.18  1.0
  Ru  Ru8  1  0.06  0.58  0.34  1.0
  Ru  Ru9  1  0.12  0.19  0.18  1.0
  Ru  Ru10  1  0.12  0.58  0.34  1.0
  Ru  Ru11  1  0.63  0.42  0.18  1.0
  Ru  Ru12  1  0.63  0.81  0.34  1.0
  Ru  Ru13  1  0.69  0.42  0.18  1.0
  Ru  Ru14  1  0.69  0.69  0.34  1.0
  Ru  Ru15  1  0.75  0.25  0.87  1.0

Te Te Te Te Te Te Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru
Te Te Te Te Te Te Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru 0 1 o o o 0 6 o - o 0 7 - o o 2 4 o o o 2 14 o o o 2 11 o o o 3 5 o o o 4 11 o o o 5 13 o o o 5 9 o o o 6 12 o o - 6 8 o o - 8 12 o o o 9 13 o o o 10 15 o o o 11 14 o o o 