# generated using pymatgen
data_Zr4In(B7Ir6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.43898364
_cell_length_b   7.84841140
_cell_length_c   13.57978955
_cell_angle_alpha   90.00391525
_cell_angle_beta   90.03461461
_cell_angle_gamma   90.12496702
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr4In(B7Ir6)2
_chemical_formula_sum   'Zr4 In1 B14 Ir12'
_cell_volume   366.52516331
_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  0.25002676  0.49681225  0.83721699  1.0
  Zr  Zr1  1  0.25238914  0.00267767  0.32909308  1.0
  Zr  Zr2  1  0.74761086  0.99732233  0.67090692  1.0
  Zr  Zr3  1  0.74997324  0.50318775  0.16278301  1.0
  In  In4  1  0.50000000  0.50000000  0.50000000  1.0
  B  B5  1  0.50000000  0.00000000  0.00000000  1.0
  B  B6  1  0.00000000  0.00000000  0.00000000  1.0
  B  B7  1  0.74685246  0.32465175  0.72994179  1.0
  B  B8  1  0.75037643  0.83121046  0.21758863  1.0
  B  B9  1  0.75093346  0.75368226  0.80724084  1.0
  B  B10  1  0.75132810  0.24772756  0.29656812  1.0
  B  B11  1  0.75094923  0.42323120  0.97474797  1.0
  B  B12  1  0.74600142  0.91834974  0.47402404  1.0
  B  B13  1  0.24962357  0.16878954  0.78241137  1.0
  B  B14  1  0.25314754  0.67534825  0.27005821  1.0
  B  B15  1  0.24867190  0.75227244  0.70343188  1.0
  B  B16  1  0.24906654  0.24631774  0.19275916  1.0
  B  B17  1  0.25399858  0.08165026  0.52597596  1.0
  B  B18  1  0.24905077  0.57676880  0.02525203  1.0
  Ir  Ir19  1  0.75018539  0.59322709  0.68174526  1.0
  Ir  Ir20  1  0.74922988  0.08869541  0.16081532  1.0
  Ir  Ir21  1  0.74986744  0.70163195  0.96275074  1.0
  Ir  Ir22  1  0.75789652  0.18976574  0.45585203  1.0
  Ir  Ir23  1  0.75040125  0.20276832  0.87630046  1.0
  Ir  Ir24  1  0.75484326  0.71869034  0.36040792  1.0
  Ir  Ir25  1  0.25077012  0.91130459  0.83918468  1.0
  Ir  Ir26  1  0.24981461  0.40677291  0.31825474  1.0
  Ir  Ir27  1  0.24210348  0.81023426  0.54414797  1.0
  Ir  Ir28  1  0.25013256  0.29836805  0.03724926  1.0
  Ir  Ir29  1  0.24515674  0.28130966  0.63959208  1.0
  Ir  Ir30  1  0.24959875  0.79723168  0.12369954  1.0