data_LaPAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45
_cell_length_b   5.33
_cell_length_c   3.96
_cell_angle_alpha   69.96
_cell_angle_beta   66.93
_cell_angle_gamma   43.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaPAu
_chemical_formula_sum   'La1 P1 Au1'
_cell_volume   72.01
_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  La1  1  0.69  0.91  0.31  1.0
  P  P2  1  0.69  0.91  0.78  1.0
  Au  Au0  1  0.69  0.91  0.12  1.0

data_LaPAu
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.38
_cell_length_b   9.21
_cell_length_c   3.96
_cell_angle_alpha   90.0
_cell_angle_beta   132.78
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LaPAu
_chemical_formula_sum   'La2 P2 Au2'
_cell_volume   144.02
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.19  0.5  1.0  1.0
  P  P1  2  0.19  0.5  0.47  1.0
  Au  Au2  2  0.19  0.5  0.81  1.0

La P Au
La P Au 0 2 o o o 1 2 o o + 