# generated using pymatgen
data_Hf2Zr2(B5Ir4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.52139421
_cell_length_b   7.55662842
_cell_length_c   13.09137412
_cell_angle_alpha   89.97331084
_cell_angle_beta   90.00201610
_cell_angle_gamma   90.00967337
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2Zr2(B5Ir4)3
_chemical_formula_sum   'Hf2 Zr2 B15 Ir12'
_cell_volume   348.35968876
_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
  Hf  Hf0  1  0.25787987  0.49840094  0.83156324  1.0
  Hf  Hf1  1  0.25827737  0.00169067  0.33504263  1.0
  Zr  Zr2  1  0.75798564  0.00043005  0.66386562  1.0
  Zr  Zr3  1  0.75800491  0.49904972  0.16959425  1.0
  B  B4  1  0.50750660  0.99974233  0.99973897  1.0
  B  B5  1  0.26230455  0.50024480  0.49983487  1.0
  B  B6  1  0.00777966  0.99974457  0.99964527  1.0
  B  B7  1  0.75844685  0.32821340  0.72146494  1.0
  B  B8  1  0.75784984  0.82668797  0.22491122  1.0
  B  B9  1  0.75773431  0.75151019  0.79972961  1.0
  B  B10  1  0.75866437  0.25153650  0.30485103  1.0
  B  B11  1  0.75778535  0.42368973  0.97431213  1.0
  B  B12  1  0.75931228  0.91771228  0.47487907  1.0
  B  B13  1  0.25766402  0.17501315  0.77452337  1.0
  B  B14  1  0.25796005  0.67493863  0.27680327  1.0
  B  B15  1  0.25784218  0.74932686  0.69842083  1.0
  B  B16  1  0.25744167  0.24935997  0.20068789  1.0
  B  B17  1  0.25702211  0.07755013  0.52472984  1.0
  B  B18  1  0.25757894  0.57514394  0.02481486  1.0
  Ir  Ir19  1  0.75783093  0.59235079  0.66801816  1.0
  Ir  Ir20  1  0.75750700  0.09003550  0.16580269  1.0
  Ir  Ir21  1  0.75756464  0.70625342  0.96108254  1.0
  Ir  Ir22  1  0.75718999  0.20166137  0.46318807  1.0
  Ir  Ir23  1  0.75766224  0.20327008  0.87239910  1.0
  Ir  Ir24  1  0.75807829  0.70541646  0.36962206  1.0
  Ir  Ir25  1  0.25764543  0.91144823  0.83637118  1.0
  Ir  Ir26  1  0.25865872  0.41150889  0.33906115  1.0
  Ir  Ir27  1  0.25903710  0.78497700  0.53621680  1.0
  Ir  Ir28  1  0.25772834  0.29121027  0.03770138  1.0
  Ir  Ir29  1  0.25840891  0.30305461  0.62494968  1.0
  Ir  Ir30  1  0.25764884  0.79882656  0.12617632  1.0