# generated using pymatgen
data_Ga3Si3(B4Ir9)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.96309929
_cell_length_b   8.96310017
_cell_length_c   5.69993131
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999313
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga3Si3(B4Ir9)2
_chemical_formula_sum   'Ga3 Si3 B8 Ir18'
_cell_volume   396.56715473
_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
  Ga  Ga0  1  0.44527170  0.98695716  0.25000000  1.0
  Ga  Ga1  1  0.54168445  0.55472830  0.25000000  1.0
  Ga  Ga2  1  0.01304284  0.45831555  0.25000000  1.0
  Si  Si3  1  0.47546575  0.02396896  0.75000000  1.0
  Si  Si4  1  0.54850421  0.52453425  0.75000000  1.0
  Si  Si5  1  0.97603104  0.45149579  0.75000000  1.0
  B  B6  1  0.81217162  0.00355990  0.50242923  1.0
  B  B7  1  0.81217162  0.00355990  0.99757077  1.0
  B  B8  1  0.99644010  0.80861172  0.50242923  1.0
  B  B9  1  0.19138828  0.18782838  0.50242923  1.0
  B  B10  1  0.19138828  0.18782838  0.99757077  1.0
  B  B11  1  0.99644010  0.80861172  0.99757077  1.0
  B  B12  1  0.66666700  0.33333300  0.25000000  1.0
  B  B13  1  0.33333300  0.66666700  0.75000000  1.0
  Ir  Ir14  1  0.81019024  0.53495550  0.50388441  1.0
  Ir  Ir15  1  0.53322024  0.82208971  0.50421009  1.0
  Ir  Ir16  1  0.00089081  0.19328769  0.75000000  1.0
  Ir  Ir17  1  0.28886847  0.46677976  0.50421009  1.0
  Ir  Ir18  1  0.00932331  0.18649007  0.25000000  1.0
  Ir  Ir19  1  0.72476626  0.18980976  0.50388441  1.0
  Ir  Ir20  1  0.81350993  0.82283424  0.25000000  1.0
  Ir  Ir21  1  0.17791029  0.71113153  0.50421009  1.0
  Ir  Ir22  1  0.46504450  0.27523374  0.50388441  1.0
  Ir  Ir23  1  0.81019024  0.53495550  0.99611559  1.0
  Ir  Ir24  1  0.46504450  0.27523374  0.99611559  1.0
  Ir  Ir25  1  0.19239788  0.99910919  0.75000000  1.0
  Ir  Ir26  1  0.17716576  0.99067669  0.25000000  1.0
  Ir  Ir27  1  0.17791029  0.71113153  0.99578991  1.0
  Ir  Ir28  1  0.80671231  0.80760212  0.75000000  1.0
  Ir  Ir29  1  0.72476626  0.18980976  0.99611559  1.0
  Ir  Ir30  1  0.28886847  0.46677976  0.99578991  1.0
  Ir  Ir31  1  0.53322024  0.82208971  0.99578991  1.0