data_InAgPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.9
_cell_length_b   8.9
_cell_length_c   8.9
_cell_angle_alpha   19.88
_cell_angle_beta   19.88
_cell_angle_gamma   19.88
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InAgPd2
_chemical_formula_sum   'In1 Ag1 Pd2'
_cell_volume   71.29
_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  In1  1  0.0  0.0  0.08  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Pd  Pd2  1  0.0  0.0  0.48  1.0
  Pd  Pd3  1  0.0  0.0  0.68  1.0

data_InAgPd2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.32
_cell_length_b   3.07
_cell_length_c   8.9
_cell_angle_alpha   90.0
_cell_angle_beta   101.5
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   InAgPd2
_chemical_formula_sum   'In2 Ag2 Pd4'
_cell_volume   142.58
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  -0.0  0.0  0.92  1.0
  Ag  Ag1  2  0.0  0.0  0.0  1.0
  Pd  Pd2  2  -0.0  0.0  0.32  1.0
  Pd  Pd3  2  0.0  0.0  0.52  1.0

In Ag Pd Pd
In Ag Pd Pd 0 1 o o o 2 3 o o o 