# generated using pymatgen
data_Nd4As3(PIr2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.03791878
_cell_length_b   12.94944142
_cell_length_c   13.29619525
_cell_angle_alpha   81.44056194
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd4As3(PIr2)4
_chemical_formula_sum   'Nd8 As6 P8 Ir16'
_cell_volume   687.49838899
_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
  Nd  Nd0  1  0.25000000  0.10442669  0.79286280  1.0
  Nd  Nd1  1  0.75000000  0.89557331  0.20713720  1.0
  Nd  Nd2  1  0.25000000  0.27858311  0.10132582  1.0
  Nd  Nd3  1  0.75000000  0.72141689  0.89867418  1.0
  Nd  Nd4  1  0.25000000  0.51528950  0.29509603  1.0
  Nd  Nd5  1  0.75000000  0.48471050  0.70490397  1.0
  Nd  Nd6  1  0.25000000  0.21154036  0.43752783  1.0
  Nd  Nd7  1  0.75000000  0.78845964  0.56247217  1.0
  As  As8  1  0.75000000  0.25431489  0.91649042  1.0
  As  As9  1  0.25000000  0.74568511  0.08350958  1.0
  As  As10  1  0.75000000  0.09433459  0.59233228  1.0
  As  As11  1  0.25000000  0.90566541  0.40766772  1.0
  As  As12  1  0.75000000  0.46501092  0.13144287  1.0
  As  As13  1  0.25000000  0.53498908  0.86855713  1.0
  P  P14  1  0.25000000  0.05363358  0.09841113  1.0
  P  P15  1  0.75000000  0.94636642  0.90158887  1.0
  P  P16  1  0.25000000  0.31551614  0.68763329  1.0
  P  P17  1  0.75000000  0.68448386  0.31236671  1.0
  P  P18  1  0.25000000  0.60871916  0.55913100  1.0
  P  P19  1  0.75000000  0.39128084  0.44086900  1.0
  P  P20  1  0.25000000  0.84821403  0.71741831  1.0
  P  P21  1  0.75000000  0.15178597  0.28258169  1.0
  Ir  Ir22  1  0.25000000  0.98515095  0.57752998  1.0
  Ir  Ir23  1  0.75000000  0.01484905  0.42247002  1.0
  Ir  Ir24  1  0.25000000  0.67157138  0.71881673  1.0
  Ir  Ir25  1  0.75000000  0.32842862  0.28118327  1.0
  Ir  Ir26  1  0.25000000  0.55273588  0.04937266  1.0
  Ir  Ir27  1  0.75000000  0.44726412  0.95062734  1.0
  Ir  Ir28  1  0.25000000  0.06283634  0.27004438  1.0
  Ir  Ir29  1  0.75000000  0.93716366  0.72995562  1.0
  Ir  Ir30  1  0.25000000  0.42537894  0.52780591  1.0
  Ir  Ir31  1  0.75000000  0.57462106  0.47219409  1.0
  Ir  Ir32  1  0.25000000  0.92349785  0.99318727  1.0
  Ir  Ir33  1  0.75000000  0.07650215  0.00681273  1.0
  Ir  Ir34  1  0.25000000  0.71918653  0.39481512  1.0
  Ir  Ir35  1  0.75000000  0.28081347  0.60518488  1.0
  Ir  Ir36  1  0.25000000  0.34424826  0.85390966  1.0
  Ir  Ir37  1  0.75000000  0.65575174  0.14609034  1.0