data_BPPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.14
_cell_length_b   6.22
_cell_length_c   6.22
_cell_angle_alpha   27.74
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BPPt2
_chemical_formula_sum   'B1 P1 Pt2'
_cell_volume   56.47
_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
  B  B0  1  0.0  0.0  0.55  1.0
  P  P1  1  0.57  0.0  0.52  1.0
  Pt  Pt2  1  0.57  0.0  0.16  1.0
  Pt  Pt3  1  0.0  0.0  0.88  1.0

data_BPPt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.98
_cell_length_b   3.14
_cell_length_c   6.22
_cell_angle_alpha   90.0
_cell_angle_beta   103.87
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BPPt2
_chemical_formula_sum   'B1 P1 Pt2'
_cell_volume   56.47
_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
  B  B0  1  0.45  0.0  0.45  1.0
  P  P1  1  0.48  0.57  0.48  1.0
  Pt  Pt2  1  0.12  0.0  0.12  1.0
  Pt  Pt3  1  0.84  0.57  0.84  1.0

B P Pt Pt