data_SrIn2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23
_cell_length_b   5.23
_cell_length_c   5.23
_cell_angle_alpha   121.14
_cell_angle_beta   121.14
_cell_angle_gamma   88.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrIn2Pd
_chemical_formula_sum   'Sr1 In2 Pd1'
_cell_volume   99.08
_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
  Sr  Sr3  1  0.0  0.0  0.0  1.0
  In  In0  1  0.57  0.0  0.88  1.0
  In  In1  1  0.0  0.0  0.76  1.0
  Pd  Pd2  1  0.0  0.57  0.88  1.0

data_SrIn2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.14
_cell_length_b   5.14
_cell_length_c   5.23
_cell_angle_alpha   119.43
_cell_angle_beta   119.43
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrIn2Pd
_chemical_formula_sum   'Sr1 In2 Pd1'
_cell_volume   99.08
_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
  Sr  Sr0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.12  0.0  0.69  1.0
  In  In2  1  0.24  0.0  0.24  1.0
  Pd  Pd3  1  0.69  0.57  0.69  1.0

Sr In In Pd