data_SrMg2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.39
_cell_length_b   6.39
_cell_length_c   6.39
_cell_angle_alpha   148.55
_cell_angle_beta   130.09
_cell_angle_gamma   60.19
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrMg2Pd
_chemical_formula_sum   'Sr1 Mg2 Pd1'
_cell_volume   103.3
_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
  Sr  Sr3  1  0.0  0.0  0.0  1.0
  Mg  Mg0  1  0.0  0.7  0.17  1.0
  Mg  Mg1  1  0.73  0.0  0.36  1.0
  Pd  Pd2  1  0.0  0.0  0.53  1.0

data_SrMg2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.46
_cell_length_b   5.39
_cell_length_c   6.39
_cell_angle_alpha   114.96
_cell_angle_beta   105.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrMg2Pd
_chemical_formula_sum   'Sr1 Mg2 Pd1'
_cell_volume   103.3
_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
  Sr  Sr0  1  0.0  0.0  0.0  1.0
  Mg  Mg1  1  0.38  0.64  0.38  1.0
  Mg  Mg2  1  0.83  0.52  0.52  1.0
  Pd  Pd3  1  0.47  0.47  0.47  1.0

Sr Mg Mg Pd