# generated using pymatgen
data_LiPr17(ZrIr6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.23354280
_cell_length_b   11.23354280
_cell_length_c   6.41728254
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiPr17(ZrIr6)2
_chemical_formula_sum   'Li1 Pr17 Zr2 Ir12'
_cell_volume   809.81282362
_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
  Li  Li0  1  0.50000000  0.50000000  0.00000000  1.0
  Pr  Pr1  1  0.28751244  0.09106356  0.38177328  1.0
  Pr  Pr2  1  0.28738254  0.91952082  0.87710809  1.0
  Pr  Pr3  1  0.71261746  0.08047918  0.87710809  1.0
  Pr  Pr4  1  0.71248756  0.90893644  0.38177328  1.0
  Pr  Pr5  1  0.57882280  0.77473518  0.88162023  1.0
  Pr  Pr6  1  0.59018361  0.20531119  0.38125590  1.0
  Pr  Pr7  1  0.40981639  0.79468881  0.38125590  1.0
  Pr  Pr8  1  0.42117720  0.22526482  0.88162023  1.0
  Pr  Pr9  1  0.20531119  0.40981639  0.61874410  1.0
  Pr  Pr10  1  0.22526482  0.57882280  0.11837977  1.0
  Pr  Pr11  1  0.77473518  0.42117720  0.11837977  1.0
  Pr  Pr12  1  0.79468881  0.59018361  0.61874410  1.0
  Pr  Pr13  1  0.91952082  0.71261746  0.12289191  1.0
  Pr  Pr14  1  0.90893644  0.28751244  0.61822672  1.0
  Pr  Pr15  1  0.09106356  0.71248756  0.61822672  1.0
  Pr  Pr16  1  0.08047918  0.28738254  0.12289191  1.0
  Pr  Pr17  1  0.50000000  0.50000000  0.50000000  1.0
  Zr  Zr18  1  0.00000000  0.00000000  0.50000000  1.0
  Zr  Zr19  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir20  1  0.86174395  0.13214590  0.24986486  1.0
  Ir  Ir21  1  0.86785410  0.86174395  0.75013514  1.0
  Ir  Ir22  1  0.13214590  0.13825605  0.75013514  1.0
  Ir  Ir23  1  0.13825605  0.86785410  0.24986486  1.0
  Ir  Ir24  1  0.65870597  0.34589302  0.73964956  1.0
  Ir  Ir25  1  0.65410698  0.65870597  0.26035044  1.0
  Ir  Ir26  1  0.34589302  0.34129403  0.26035044  1.0
  Ir  Ir27  1  0.34129403  0.65410698  0.73964956  1.0
  Ir  Ir28  1  0.50000000  0.00000000  0.10895651  1.0
  Ir  Ir29  1  0.50000000  0.00000000  0.62003130  1.0
  Ir  Ir30  1  0.00000000  0.50000000  0.89104349  1.0
  Ir  Ir31  1  0.00000000  0.50000000  0.37996870  1.0