data_LaReP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.43
_cell_length_b   5.67
_cell_length_c   5.67
_cell_angle_alpha   39.29
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaReP2
_chemical_formula_sum   'La1 Re1 P2'
_cell_volume   90.28
_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  0.66  1.0
  Re  Re3  1  0.22  0.0  0.13  1.0
  P  P1  1  0.22  0.0  0.14  1.0
  P  P2  1  0.0  0.0  0.69  1.0

data_LaReP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.81
_cell_length_b   4.43
_cell_length_c   5.67
_cell_angle_alpha   90.0
_cell_angle_beta   109.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaReP2
_chemical_formula_sum   'La1 Re1 P2'
_cell_volume   90.28
_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  0.34  0.0  0.34  1.0
  Re  Re1  1  0.87  0.22  0.87  1.0
  P  P2  1  0.31  0.0  0.31  1.0
  P  P3  1  0.86  0.22  0.86  1.0

La Re P P