data_LaSiPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   5.04
_cell_angle_alpha   136.22
_cell_angle_beta   119.32
_cell_angle_gamma   77.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaSiPd2
_chemical_formula_sum   'La1 Si1 Pd2'
_cell_volume   75.24
_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
  La  La0  1  0.0  0.0  0.93  1.0
  Si  Si3  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.0  0.55  0.14  1.0
  Pd  Pd2  1  0.88  0.0  0.79  1.0

data_LaSiPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.76
_cell_length_b   5.04
_cell_length_c   5.04
_cell_angle_alpha   60.68
_cell_angle_beta   68.11
_cell_angle_gamma   68.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaSiPd2
_chemical_formula_sum   'La1 Si1 Pd2'
_cell_volume   75.24
_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
  La  La0  1  0.93  -0.0  0.07  1.0
  Si  Si1  1  0.0  0.0  0.0  1.0
  Pd  Pd2  1  0.14  -0.0  0.41  1.0
  Pd  Pd3  1  0.91  0.88  0.21  1.0

La Si Pd Pd