# generated using pymatgen
data_Zr6Ti14Al2Ir7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.93149525
_cell_length_b   8.92291264
_cell_length_c   8.92291260
_cell_angle_alpha   59.76771082
_cell_angle_beta   59.96817798
_cell_angle_gamma   59.96817633
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6Ti14Al2Ir7
_chemical_formula_sum   'Zr6 Ti14 Al2 Ir7'
_cell_volume   501.70208001
_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  0.68498133  0.68881475  0.31150325  1.0
  Zr  Zr1  1  0.31469967  0.68881475  0.31150325  1.0
  Zr  Zr2  1  0.69064645  0.30935355  0.30935355  1.0
  Zr  Zr3  1  0.31469967  0.31150325  0.68881475  1.0
  Zr  Zr4  1  0.68498133  0.31150325  0.68881475  1.0
  Zr  Zr5  1  0.31428140  0.68571860  0.68571860  1.0
  Ti  Ti6  1  0.35621704  0.88042171  0.88042171  1.0
  Ti  Ti7  1  0.88294053  0.88042171  0.88042171  1.0
  Ti  Ti8  1  0.11317810  0.12620476  0.64743805  1.0
  Ti  Ti9  1  0.11317810  0.64743805  0.12620476  1.0
  Ti  Ti10  1  0.64555357  0.12139658  0.12139658  1.0
  Ti  Ti11  1  0.11165126  0.12139658  0.12139658  1.0
  Ti  Ti12  1  0.67028101  0.66891890  0.99051707  1.0
  Ti  Ti13  1  0.67028101  0.99051707  0.66891890  1.0
  Ti  Ti14  1  0.00208053  0.66550079  0.66550079  1.0
  Ti  Ti15  1  0.66691690  0.66550079  0.66550079  1.0
  Ti  Ti16  1  0.32972089  0.33054015  0.01002007  1.0
  Ti  Ti17  1  0.32972089  0.01002007  0.33054015  1.0
  Ti  Ti18  1  0.00800740  0.33079728  0.33079728  1.0
  Ti  Ti19  1  0.33040104  0.33079728  0.33079728  1.0
  Al  Al20  1  0.88040563  0.88117948  0.35800925  1.0
  Al  Al21  1  0.88040563  0.35800925  0.88117948  1.0
  Ir  Ir22  1  0.00205087  0.99794913  0.99794913  1.0
  Ir  Ir23  1  0.99988436  0.99980099  0.49866490  1.0
  Ir  Ir24  1  0.50164974  0.99980099  0.49866490  1.0
  Ir  Ir25  1  0.99916053  0.50083947  0.50083947  1.0
  Ir  Ir26  1  0.50164974  0.49866490  0.99980099  1.0
  Ir  Ir27  1  0.99988436  0.49866490  0.99980099  1.0
  Ir  Ir28  1  0.50049102  0.99950898  0.99950898  1.0