data_SnB2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.22
_cell_length_b   4.22
_cell_length_c   4.13
_cell_angle_alpha   113.09
_cell_angle_beta   113.09
_cell_angle_gamma   101.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnB2P
_chemical_formula_sum   'Sn1 B2 P1'
_cell_volume   56.51
_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
  Sn  Sn3  1  0.67  0.0  0.0  1.0
  B  B0  1  0.05  0.63  0.62  1.0
  B  B1  1  0.05  0.37  0.62  1.0
  P  P2  1  0.0  0.0  0.0  1.0

data_SnB2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.13
_cell_length_b   4.22
_cell_length_c   4.22
_cell_angle_alpha   101.5
_cell_angle_beta   113.09
_cell_angle_gamma   113.09
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnB2P
_chemical_formula_sum   'Sn1 B2 P1'
_cell_volume   56.51
_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
  Sn  Sn0  1  -0.0  0.67  0.0  1.0
  B  B1  1  0.62  0.05  0.37  1.0
  B  B2  1  0.62  0.05  0.63  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Sn B B P