data_In2PRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45
_cell_length_b   5.45
_cell_length_c   3.36
_cell_angle_alpha   106.75
_cell_angle_beta   106.75
_cell_angle_gamma   115.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2PRu
_chemical_formula_sum   'In2 P1 Ru1'
_cell_volume   75.86
_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
  In  In0  1  0.55  0.7  0.41  1.0
  In  In1  1  0.55  0.3  0.41  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Ru  Ru3  1  0.91  0.0  0.0  1.0

data_In2PRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   4.91
_cell_length_c   5.45
_cell_angle_alpha   115.88
_cell_angle_beta   106.75
_cell_angle_gamma   92.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2PRu
_chemical_formula_sum   'In2 P1 Ru1'
_cell_volume   75.86
_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
  In  In0  1  0.11  0.7  0.25  1.0
  In  In1  1  0.72  0.3  0.85  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Ru  Ru3  1  0.0  0.0  0.91  1.0

In In P Ru