data_BiPt3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85
_cell_length_b   5.85
_cell_length_c   14.72
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BiPt3
_chemical_formula_sum   'Bi6 Pt18'
_cell_volume   436.32
_cell_formula_units_Z   6
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
  Bi  Bi0  1  0.0  0.0  0.68  1.0
  Bi  Bi1  1  0.0  0.0  0.04  1.0
  Bi  Bi2  1  0.93  0.69  0.33  1.0
  Bi  Bi3  1  0.93  0.69  0.75  1.0
  Bi  Bi4  1  0.0  0.38  0.97  1.0
  Bi  Bi5  1  0.0  0.38  0.39  1.0
  Pt  Pt6  1  0.93  0.09  0.68  1.0
  Pt  Pt7  1  0.31  0.49  0.68  1.0
  Pt  Pt8  1  0.54  0.49  0.68  1.0
  Pt  Pt9  1  0.0  0.97  0.04  1.0
  Pt  Pt10  1  0.62  0.58  0.04  1.0
  Pt  Pt11  1  0.38  0.58  0.04  1.0
  Pt  Pt12  1  0.93  0.38  0.19  1.0
  Pt  Pt13  1  0.46  0.84  0.19  1.0
  Pt  Pt14  1  0.39  0.84  0.19  1.0
  Pt  Pt15  1  0.93  0.38  0.17  1.0
  Pt  Pt16  1  0.46  0.84  0.17  1.0
  Pt  Pt17  1  0.39  0.84  0.17  1.0
  Pt  Pt18  1  0.0  0.69  0.53  1.0
  Pt  Pt19  1  0.46  0.22  0.53  1.0
  Pt  Pt20  1  0.54  0.22  0.53  1.0
  Pt  Pt21  1  0.0  0.69  0.54  1.0
  Pt  Pt22  1  0.46  0.22  0.54  1.0
  Pt  Pt23  1  0.54  0.22  0.54  1.0

data_BiPt3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.85
_cell_length_b   5.85
_cell_length_c   14.72
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BiPt3
_chemical_formula_sum   'Bi6 Pt18'
_cell_volume   436.32
_cell_formula_units_Z   6
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
  Bi  Bi0  1  -0.0  0.38  0.39  1.0
  Bi  Bi1  1  -0.0  0.38  0.97  1.0
  Bi  Bi2  1  0.0  0.0  0.04  1.0
  Bi  Bi3  1  0.0  0.0  0.68  1.0
  Bi  Bi4  1  0.93  0.69  0.33  1.0
  Bi  Bi5  1  0.93  0.69  0.75  1.0
  Pt  Pt6  1  -0.0  0.97  0.04  1.0
  Pt  Pt7  1  -0.0  0.69  0.53  1.0
  Pt  Pt8  1  -0.0  0.69  0.54  1.0
  Pt  Pt9  1  0.31  0.49  0.68  1.0
  Pt  Pt10  1  0.38  0.58  0.04  1.0
  Pt  Pt11  1  0.39  0.84  0.17  1.0
  Pt  Pt12  1  0.39  0.84  0.19  1.0
  Pt  Pt13  1  0.46  0.84  0.17  1.0
  Pt  Pt14  1  0.46  0.84  0.19  1.0
  Pt  Pt15  1  0.46  0.22  0.53  1.0
  Pt  Pt16  1  0.46  0.22  0.54  1.0
  Pt  Pt17  1  0.54  0.22  0.53  1.0
  Pt  Pt18  1  0.54  0.22  0.54  1.0
  Pt  Pt19  1  0.54  0.49  0.68  1.0
  Pt  Pt20  1  0.62  0.58  0.04  1.0
  Pt  Pt21  1  0.93  0.09  0.68  1.0
  Pt  Pt22  1  0.93  0.38  0.17  1.0
  Pt  Pt23  1  0.93  0.38  0.19  1.0

Bi Bi Bi Bi Bi Bi Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt