data_BRuPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15
_cell_length_b   5.15
_cell_length_c   5.15
_cell_angle_alpha   149.16
_cell_angle_beta   149.16
_cell_angle_gamma   44.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BRuPt
_chemical_formula_sum   'B1 Ru1 Pt1'
_cell_volume   35.83
_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  0.18  1.0
  Ru  Ru2  1  0.0  0.0  0.02  1.0
  Pt  Pt1  1  0.0  0.0  0.35  1.0

data_BRuPt
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.87
_cell_length_b   3.87
_cell_length_c   5.15
_cell_angle_alpha   90.0
_cell_angle_beta   112.09
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BRuPt
_chemical_formula_sum   'B2 Ru2 Pt2'
_cell_volume   71.67
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.18  0.0  0.18  1.0
  Ru  Ru1  2  0.02  0.0  0.02  1.0
  Pt  Pt2  2  0.35  0.0  0.35  1.0

B Ru Pt
B Ru Pt 0 1 o o o 0 2 o o o 