data_SrLaPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.69
_cell_length_b   3.69
_cell_length_c   7.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.31
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrLaPd2
_chemical_formula_sum   'Sr1 La1 Pd2'
_cell_volume   102.29
_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
  Sr  Sr3  1  0.0  0.0  0.0  1.0
  La  La0  1  0.0  0.0  0.76  1.0
  Pd  Pd1  1  0.56  0.0  0.39  1.0
  Pd  Pd2  1  0.56  0.0  0.12  1.0

data_SrLaPd2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.69
_cell_length_b   3.69
_cell_length_c   7.51
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   SrLaPd2
_chemical_formula_sum   'Sr1 La1 Pd2'
_cell_volume   102.37
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  La  La1  1  0.0  0.0  0.76  1.0
  Pd  Pd2  1  0.56  0.0  0.12  1.0
  Pd  Pd3  1  0.56  0.0  0.39  1.0

Sr La Pd Pd
Sr La Pd Pd 0 3 - o o 0 3 o o o 0 1 o o - 2 3 o o o 