# generated using pymatgen
data_LuInBPt6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84114359
_cell_length_b   5.84114319
_cell_length_c   5.84114361
_cell_angle_alpha   60.00000314
_cell_angle_beta   60.00000540
_cell_angle_gamma   60.00000134
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuInBPt6
_chemical_formula_sum   'Lu1 In1 B1 Pt6'
_cell_volume   140.92195334
_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
  Lu  Lu0  1  0.25000000  0.25000000  0.25000000  1.0
  In  In1  1  0.75000000  0.75000000  0.75000000  1.0
  B  B2  1  0.49999900  0.49999900  0.49999900  1.0
  Pt  Pt3  1  0.24382500  0.75617400  0.24382500  1.0
  Pt  Pt4  1  0.75617400  0.75617400  0.24382500  1.0
  Pt  Pt5  1  0.75617400  0.24382500  0.24382500  1.0
  Pt  Pt6  1  0.24382500  0.24382500  0.75617400  1.0
  Pt  Pt7  1  0.75617400  0.24382500  0.75617400  1.0
  Pt  Pt8  1  0.24382500  0.75617400  0.75617400  1.0