# generated using pymatgen
data_Ba2AsP3Ir4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.03904257
_cell_length_b   7.03904233
_cell_length_c   5.64320750
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   132.69964763
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2AsP3Ir4
_chemical_formula_sum   'Ba2 As1 P3 Ir4'
_cell_volume   205.49086714
_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
  Ba  Ba0  1  0.49782614  0.50217386  0.50000000  1.0
  Ba  Ba1  1  0.99138566  0.00861434  0.00000000  1.0
  As  As2  1  0.13407928  0.86592072  0.50000000  1.0
  P  P3  1  0.65695702  0.34304298  0.00000000  1.0
  P  P4  1  0.35010637  0.64989363  0.00000000  1.0
  P  P5  1  0.84706645  0.15293355  0.50000000  1.0
  Ir  Ir6  1  0.50077663  0.99653609  0.25003762  1.0
  Ir  Ir7  1  0.00346391  0.49922337  0.74996238  1.0
  Ir  Ir8  1  0.00346391  0.49922337  0.25003762  1.0
  Ir  Ir9  1  0.50077663  0.99653609  0.74996238  1.0