# generated using pymatgen
data_Mg4In4BIr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.65671339
_cell_length_b   8.68662490
_cell_length_c   8.59476844
_cell_angle_alpha   60.63798564
_cell_angle_beta   60.51447796
_cell_angle_gamma   60.47539085
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg4In4BIr4
_chemical_formula_sum   'Mg8 In8 B2 Ir8'
_cell_volume   462.60823310
_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
  Mg  Mg0  1  0.12649570  0.12347812  0.62502256  1.0
  Mg  Mg1  1  0.54240087  0.95553644  0.54431873  1.0
  Mg  Mg2  1  0.12628051  0.62417013  0.12329296  1.0
  Mg  Mg3  1  0.54268373  0.54508119  0.95352982  1.0
  Mg  Mg4  1  0.95830365  0.54448565  0.95476979  1.0
  Mg  Mg5  1  0.12593495  0.12557517  0.12448028  1.0
  Mg  Mg6  1  0.62163487  0.12542270  0.12531330  1.0
  Mg  Mg7  1  0.29701749  0.70565199  0.70835730  1.0
  In  In8  1  0.95787980  0.94681088  0.54977483  1.0
  In  In9  1  0.30379435  0.69944770  0.29256864  1.0
  In  In10  1  0.69765511  0.30589636  0.70466518  1.0
  In  In11  1  0.29514853  0.29941508  0.70360100  1.0
  In  In12  1  0.70534537  0.29786265  0.28729694  1.0
  In  In13  1  0.70420881  0.70637771  0.29655149  1.0
  In  In14  1  0.94540275  0.55432004  0.55404383  1.0
  In  In15  1  0.55756252  0.94266004  0.94334345  1.0
  B  B16  1  0.24663646  0.24378559  0.25303121  1.0
  B  B17  1  0.00450236  0.00512814  0.99678970  1.0
  Ir  Ir18  1  0.90320297  0.90088746  0.90594594  1.0
  Ir  Ir19  1  0.89901818  0.29715749  0.90272929  1.0
  Ir  Ir20  1  0.29671544  0.89985809  0.90118132  1.0
  Ir  Ir21  1  0.34640434  0.34925995  0.95796584  1.0
  Ir  Ir22  1  0.95140397  0.35032688  0.35047642  1.0
  Ir  Ir23  1  0.90000613  0.90316695  0.29280347  1.0
  Ir  Ir24  1  0.34840621  0.95071226  0.35075386  1.0
  Ir  Ir25  1  0.34595493  0.34752335  0.34739485  1.0