# generated using pymatgen
data_KBa4(IrN)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.08240286
_cell_length_b   9.22775272
_cell_length_c   3.77478525
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.53081822
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KBa4(IrN)3
_chemical_formula_sum   'K1 Ba4 Ir3 N3'
_cell_volume   272.50323564
_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
  K  K0  1  0.00000000  0.81206150  0.50000000  1.0
  Ba  Ba1  1  0.71561747  0.98214036  0.50000000  1.0
  Ba  Ba2  1  0.28438353  0.26652389  0.50000000  1.0
  Ba  Ba3  1  0.70986560  0.36672057  0.50000000  1.0
  Ba  Ba4  1  0.29013440  0.65685397  0.50000000  1.0
  Ir  Ir5  1  0.40208725  0.01910832  0.00000000  1.0
  Ir  Ir6  1  1.00000000  0.32177055  0.00000000  1.0
  Ir  Ir7  1  0.59791275  0.61702107  0.00000000  1.0
  N  N8  1  0.40117305  0.01853487  0.50000000  1.0
  N  N9  1  1.00000000  0.32190407  0.50000000  1.0
  N  N10  1  0.59882795  0.61736182  0.50000000  1.0