# generated using pymatgen
data_Zr4(B5Ir4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.53841148
_cell_length_b   7.54848907
_cell_length_c   13.08780015
_cell_angle_alpha   90.06011745
_cell_angle_beta   90.02878940
_cell_angle_gamma   90.01452888
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr4(B5Ir4)3
_chemical_formula_sum   'Zr4 B15 Ir12'
_cell_volume   349.57044930
_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
  Zr  Zr0  1  0.25135581  0.49962716  0.83096779  1.0
  Zr  Zr1  1  0.25339435  0.00091540  0.33563960  1.0
  Zr  Zr2  1  0.74660565  0.99908460  0.66436040  1.0
  Zr  Zr3  1  0.74864419  0.50037284  0.16903221  1.0
  B  B4  1  0.50000000  -0.00000000  0.00000000  1.0
  B  B5  1  0.50000000  0.50000000  0.50000000  1.0
  B  B6  1  0.00000000  -0.00000000  0.00000000  1.0
  B  B7  1  0.76323037  0.32648416  0.72210204  1.0
  B  B8  1  0.75650732  0.82596843  0.22508619  1.0
  B  B9  1  0.75500088  0.75066037  0.79926726  1.0
  B  B10  1  0.76467422  0.25237783  0.30368333  1.0
  B  B11  1  0.74967522  0.42359549  0.97496830  1.0
  B  B12  1  0.77360716  0.92050950  0.47552324  1.0
  B  B13  1  0.24349268  0.17403157  0.77491381  1.0
  B  B14  1  0.23676963  0.67351584  0.27789796  1.0
  B  B15  1  0.23532578  0.74762217  0.69631667  1.0
  B  B16  1  0.24499912  0.24933963  0.20073274  1.0
  B  B17  1  0.22639284  0.07949050  0.52447676  1.0
  B  B18  1  0.25032478  0.57640451  0.02503170  1.0
  Ir  Ir19  1  0.73710265  0.59038941  0.66325558  1.0
  Ir  Ir20  1  0.74825927  0.09042051  0.16483769  1.0
  Ir  Ir21  1  0.75123226  0.70789324  0.96198344  1.0
  Ir  Ir22  1  0.73043831  0.20991515  0.46453557  1.0
  Ir  Ir23  1  0.74715378  0.20106997  0.87278999  1.0
  Ir  Ir24  1  0.73902060  0.70051281  0.37210484  1.0
  Ir  Ir25  1  0.25174073  0.90957949  0.83516231  1.0
  Ir  Ir26  1  0.26289735  0.40961059  0.33674442  1.0
  Ir  Ir27  1  0.26956169  0.79008485  0.53546443  1.0
  Ir  Ir28  1  0.24876774  0.29210676  0.03801656  1.0
  Ir  Ir29  1  0.26097940  0.29948719  0.62789516  1.0
  Ir  Ir30  1  0.25284622  0.79893003  0.12721001  1.0