data_BPt2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14
_cell_length_b   5.14
_cell_length_c   5.14
_cell_angle_alpha   145.66
_cell_angle_beta   97.8
_cell_angle_gamma   92.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BPt2Cl
_chemical_formula_sum   'B1 Pt2 Cl1'
_cell_volume   73.11
_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  0.0  1.0
  Pt  Pt2  1  0.52  0.0  0.34  1.0
  Pt  Pt3  1  0.0  0.38  0.22  1.0
  Cl  Cl1  1  0.0  0.0  0.56  1.0

data_BPt2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.04
_cell_length_b   5.14
_cell_length_c   5.14
_cell_angle_alpha   82.2
_cell_angle_beta   72.83
_cell_angle_gamma   72.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BPt2Cl
_chemical_formula_sum   'B1 Pt2 Cl1'
_cell_volume   73.11
_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  0.0  1.0
  Pt  Pt1  1  -0.0  0.48  0.34  1.0
  Pt  Pt2  1  0.38  0.0  0.85  1.0
  Cl  Cl3  1  -0.0  0.0  0.56  1.0

B Pt Pt Cl