data_LaSnP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.77
_cell_length_b   3.77
_cell_length_c   7.25
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   102.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaSnP2
_chemical_formula_sum   'La1 Sn1 P2'
_cell_volume   100.49
_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  0.35  0.0  0.39  1.0
  Sn  Sn3  1  0.0  0.0  0.1  1.0
  P  P1  1  0.0  0.0  0.01  1.0
  P  P2  1  0.35  0.0  0.38  1.0

data_LaSnP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.77
_cell_length_b   3.77
_cell_length_c   7.25
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   102.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaSnP2
_chemical_formula_sum   'La1 Sn1 P2'
_cell_volume   100.49
_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  0.35  0.0  0.39  1.0
  Sn  Sn1  1  0.0  0.0  0.1  1.0
  P  P2  1  0.0  0.0  0.01  1.0
  P  P3  1  0.35  0.0  0.38  1.0

La Sn P P
La Sn P P 0 3 o o o 1 2 o o o 