data_NbSnP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.8
_cell_length_b   4.8
_cell_length_c   3.32
_cell_angle_alpha   100.71
_cell_angle_beta   100.71
_cell_angle_gamma   97.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbSnP2
_chemical_formula_sum   'Nb1 Sn1 P2'
_cell_volume   72.59
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Sn  Sn3  1  0.16  0.0  0.0  1.0
  P  P1  1  0.11  0.8  0.59  1.0
  P  P2  1  0.11  0.2  0.59  1.0

data_NbSnP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.32
_cell_length_b   4.8
_cell_length_c   4.8
_cell_angle_alpha   97.64
_cell_angle_beta   100.71
_cell_angle_gamma   100.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbSnP2
_chemical_formula_sum   'Nb1 Sn1 P2'
_cell_volume   72.59
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.0  0.16  0.0  1.0
  P  P2  1  0.59  0.11  0.8  1.0
  P  P3  1  0.59  0.11  0.2  1.0

Nb Sn P P