# generated using pymatgen
data_LiZr3P2Ir3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.33202111
_cell_length_b   6.33202014
_cell_length_c   3.98067285
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000506
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiZr3P2Ir3
_chemical_formula_sum   'Li1 Zr3 P2 Ir3'
_cell_volume   138.22027029
_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  0.00000000  0.00000000  0.50000000  1.0
  Zr  Zr1  1  0.00000000  0.41980108  0.50000000  1.0
  Zr  Zr2  1  0.58019892  0.58019892  0.50000000  1.0
  Zr  Zr3  1  0.41980108  0.00000000  0.50000000  1.0
  P  P4  1  0.66666700  0.33333300  0.00000000  1.0
  P  P5  1  0.33333300  0.66666700  0.00000000  1.0
  Ir  Ir6  1  1.00000000  0.75256078  0.00000000  1.0
  Ir  Ir7  1  0.24743922  0.24743922  0.00000000  1.0
  Ir  Ir8  1  0.75256078  0.00000000  0.00000000  1.0