# generated using pymatgen
data_LiIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.68349041
_cell_length_b   4.66611439
_cell_length_c   5.12879330
_cell_angle_alpha   117.03557232
_cell_angle_beta   105.20465338
_cell_angle_gamma   89.99296637
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiIr3
_chemical_formula_sum   'Li1 Ir3'
_cell_volume   54.66763795
_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  0.99871371  0.01664780  0.00016399  1.0
  Ir  Ir1  1  0.24104345  0.93354462  0.48053986  1.0
  Ir  Ir2  1  0.75967895  0.45289270  0.51935039  1.0
  Ir  Ir3  1  0.50056588  0.50091488  -0.00005624  1.0