# generated using pymatgen
data_Zr6Al16Ir7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.68907893
_cell_length_b   8.68907684
_cell_length_c   8.68911254
_cell_angle_alpha   59.99996756
_cell_angle_beta   59.99960102
_cell_angle_gamma   59.99970189
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6Al16Ir7
_chemical_formula_sum   'Zr6 Al16 Ir7'
_cell_volume   463.87974535
_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  0.68962480  0.68966062  0.31035517  1.0
  Zr  Zr1  1  0.31036422  0.68965475  0.31034808  1.0
  Zr  Zr2  1  0.68963088  0.31035099  0.31037038  1.0
  Zr  Zr3  1  0.31037654  0.31033952  0.68964277  1.0
  Zr  Zr4  1  0.68963603  0.31034488  0.68965230  1.0
  Zr  Zr5  1  0.31036862  0.68964949  0.68962991  1.0
  Al  Al6  1  0.88025976  0.88022780  0.35925994  1.0
  Al  Al7  1  0.88026858  0.35926042  0.88023577  1.0
  Al  Al8  1  0.35925977  0.88022929  0.88025550  1.0
  Al  Al9  1  0.88026623  0.88023230  0.88024124  1.0
  Al  Al10  1  0.11974002  0.11977225  0.64074013  1.0
  Al  Al11  1  0.11973111  0.64073960  0.11976443  1.0
  Al  Al12  1  0.64074006  0.11977065  0.11974476  1.0
  Al  Al13  1  0.11973355  0.11976763  0.11975900  1.0
  Al  Al14  1  0.66318993  0.66317984  0.01044475  1.0
  Al  Al15  1  0.66319039  0.01043809  0.66318581  1.0
  Al  Al16  1  0.01045131  0.66317900  0.66318477  1.0
  Al  Al17  1  0.66319016  0.66317959  0.66318541  1.0
  Al  Al18  1  0.33681003  0.33682020  0.98955528  1.0
  Al  Al19  1  0.33680965  0.98956185  0.33681426  1.0
  Al  Al20  1  0.98954881  0.33682088  0.33681532  1.0
  Al  Al21  1  0.33680974  0.33682044  0.33681465  1.0
  Ir  Ir22  1  -0.00000000  -0.00000001  -0.00000009  1.0
  Ir  Ir23  1  0.00000010  -0.00000011  0.50000016  1.0
  Ir  Ir24  1  0.49999983  0.00000002  0.50000010  1.0
  Ir  Ir25  1  0.00000009  0.49999990  0.50000000  1.0
  Ir  Ir26  1  0.49999977  0.50000009  0.00000014  1.0
  Ir  Ir27  1  0.00000007  0.49999997  -0.00000004  1.0
  Ir  Ir28  1  0.49999994  0.00000006  0.00000008  1.0