# generated using pymatgen
data_Zr2MnIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07677551
_cell_length_b   5.32256410
_cell_length_c   8.63373345
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   121.61489687
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2MnIr3
_chemical_formula_sum   'Zr4 Mn2 Ir6'
_cell_volume   198.67279020
_cell_formula_units_Z   2
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  0.33605941  0.66802971  0.06837004  1.0
  Zr  Zr1  1  0.66394059  0.33197029  0.56837004  1.0
  Zr  Zr2  1  0.66394059  0.33197029  0.93162996  1.0
  Zr  Zr3  1  0.33605941  0.66802971  0.43162996  1.0
  Mn  Mn4  1  0.67684162  0.83842031  0.75000000  1.0
  Mn  Mn5  1  0.32315838  0.16157969  0.25000000  1.0
  Ir  Ir6  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir7  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir8  1  0.18105574  0.34530425  0.75000000  1.0
  Ir  Ir9  1  0.81894426  0.16424951  0.25000000  1.0
  Ir  Ir10  1  0.81894426  0.65469575  0.25000000  1.0
  Ir  Ir11  1  0.18105574  0.83575049  0.75000000  1.0