data_MgInPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26
_cell_length_b   5.26
_cell_length_c   5.26
_cell_angle_alpha   136.4
_cell_angle_beta   136.4
_cell_angle_gamma   63.37
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgInPd2
_chemical_formula_sum   'Mg1 In1 Pd2'
_cell_volume   68.3
_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
  Mg  Mg1  1  0.0  0.0  0.0  1.0
  In  In0  1  0.0  0.95  0.24  1.0
  Pd  Pd2  1  0.95  0.0  0.24  1.0
  Pd  Pd3  1  0.0  0.0  0.48  1.0

data_MgInPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.91
_cell_length_b   3.91
_cell_length_c   5.26
_cell_angle_alpha   111.8
_cell_angle_beta   111.8
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgInPd2
_chemical_formula_sum   'Mg1 In1 Pd2'
_cell_volume   68.3
_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
  Mg  Mg0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.28  0.24  0.28  1.0
  Pd  Pd2  1  0.24  0.28  0.28  1.0
  Pd  Pd3  1  0.48  0.48  0.48  1.0

Mg In Pd Pd