data_LaGe2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.45
_cell_length_b   4.34
_cell_length_c   4.91
_cell_angle_alpha   90.0
_cell_angle_beta   93.67
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaGe2Pt
_chemical_formula_sum   'La1 Ge2 Pt1'
_cell_volume   94.64
_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  La2  1  0.02  0.0  0.28  1.0
  Ge  Ge0  1  0.68  0.0  0.85  1.0
  Ge  Ge1  1  0.33  0.17  0.8  1.0
  Pt  Pt3  1  0.31  0.17  0.33  1.0

data_LaGe2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.34
_cell_length_b   4.45
_cell_length_c   4.91
_cell_angle_alpha   93.67
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaGe2Pt
_chemical_formula_sum   'La1 Ge2 Pt1'
_cell_volume   94.64
_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  0.98  0.72  1.0
  Ge  Ge1  1  0.0  0.32  0.15  1.0
  Ge  Ge2  1  0.83  0.67  0.2  1.0
  Pt  Pt3  1  0.83  0.69  0.67  1.0

La Ge Ge Pt