data_LaYPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.1
_cell_length_b   5.1
_cell_length_c   3.52
_cell_angle_alpha   92.29
_cell_angle_beta   92.29
_cell_angle_gamma   91.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaYPt2
_chemical_formula_sum   'La1 Y1 Pt2'
_cell_volume   91.38
_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  0.56  0.0  0.0  1.0
  Y  Y3  1  0.0  0.0  0.0  1.0
  Pt  Pt1  1  0.68  0.83  0.76  1.0
  Pt  Pt2  1  0.68  0.17  0.76  1.0

data_LaYPt2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.52
_cell_length_b   5.1
_cell_length_c   5.1
_cell_angle_alpha   90.0
_cell_angle_beta   92.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   LaYPt2
_chemical_formula_sum   'La1 Y1 Pt2'
_cell_volume   91.49
_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
  La  La0  1  -0.0  0.0  0.56  1.0
  Y  Y1  1  0.0  0.0  0.0  1.0
  Pt  Pt2  2  0.76  0.17  0.68  1.0

La Y Pt Pt