# generated using pymatgen
data_Y2Lu2BCl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.78734330
_cell_length_b   12.40516387
_cell_length_c   12.84959652
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2Lu2BCl6
_chemical_formula_sum   'Y4 Lu4 B2 Cl12'
_cell_volume   603.70763704
_cell_formula_units_Z   2
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
  Y  Y0  1  0.50000000  0.12816271  0.84946146  1.0
  Y  Y1  1  0.50000000  0.87183729  0.15053854  1.0
  Y  Y2  1  0.50000000  0.62816271  0.65053854  1.0
  Y  Y3  1  0.50000000  0.37183729  0.34946146  1.0
  Lu  Lu4  1  0.00000000  0.10369165  0.08229591  1.0
  Lu  Lu5  1  0.00000000  0.89630835  0.91770409  1.0
  Lu  Lu6  1  0.00000000  0.60369165  0.41770409  1.0
  Lu  Lu7  1  0.00000000  0.39630835  0.58229591  1.0
  B  B8  1  0.50000000  0.00000000  0.00000000  1.0
  B  B9  1  0.50000000  0.50000000  0.50000000  1.0
  Cl  Cl10  1  0.50000000  0.27148339  0.68007370  1.0
  Cl  Cl11  1  0.50000000  0.72851661  0.31992630  1.0
  Cl  Cl12  1  0.50000000  0.77148339  0.81992630  1.0
  Cl  Cl13  1  0.50000000  0.22851661  0.18007370  1.0
  Cl  Cl14  1  0.00000000  0.25985519  0.93479623  1.0
  Cl  Cl15  1  0.00000000  0.74014481  0.06520377  1.0
  Cl  Cl16  1  0.00000000  0.48421585  0.24130915  1.0
  Cl  Cl17  1  0.00000000  0.51578415  0.75869085  1.0
  Cl  Cl18  1  0.00000000  0.98421585  0.25869085  1.0
  Cl  Cl19  1  0.00000000  0.01578415  0.74130915  1.0
  Cl  Cl20  1  0.00000000  0.24014481  0.43479623  1.0
  Cl  Cl21  1  0.00000000  0.75985519  0.56520377  1.0