# generated using pymatgen
data_Nd5Pa3(P7Ir8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97165648
_cell_length_b   12.69305654
_cell_length_c   13.17236422
_cell_angle_alpha   80.67961110
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd5Pa3(P7Ir8)2
_chemical_formula_sum   'Nd5 Pa3 P14 Ir16'
_cell_volume   655.28458018
_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
  Nd  Nd0  1  0.25000000  0.52014681  0.29285931  1.0
  Nd  Nd1  1  0.75000000  0.71820075  0.89904937  1.0
  Nd  Nd2  1  0.25000000  0.10350493  0.78980685  1.0
  Nd  Nd3  1  0.75000000  0.89605871  0.21018310  1.0
  Nd  Nd4  1  0.25000000  0.28210716  0.09789507  1.0
  Pa  Pa5  1  0.75000000  0.79167046  0.56143079  1.0
  Pa  Pa6  1  0.25000000  0.21032598  0.43684275  1.0
  Pa  Pa7  1  0.75000000  0.48465915  0.70972205  1.0
  P  P8  1  0.25000000  0.91096328  0.40887813  1.0
  P  P9  1  0.75000000  0.46724097  0.12963608  1.0
  P  P10  1  0.25000000  0.53268713  0.87261635  1.0
  P  P11  1  0.75000000  0.09118059  0.59169914  1.0
  P  P12  1  0.25000000  0.74153477  0.08206208  1.0
  P  P13  1  0.75000000  0.25708285  0.91845247  1.0
  P  P14  1  0.75000000  0.15561309  0.28017240  1.0
  P  P15  1  0.25000000  0.84020872  0.71810902  1.0
  P  P16  1  0.25000000  0.05099370  0.09933136  1.0
  P  P17  1  0.75000000  0.94766050  0.89964492  1.0
  P  P18  1  0.25000000  0.31510616  0.68909124  1.0
  P  P19  1  0.75000000  0.68594525  0.31125822  1.0
  P  P20  1  0.25000000  0.60772129  0.56146134  1.0
  P  P21  1  0.75000000  0.39337195  0.43688787  1.0
  Ir  Ir22  1  0.25000000  0.98881980  0.57398599  1.0
  Ir  Ir23  1  0.75000000  0.01313560  0.42615234  1.0
  Ir  Ir24  1  0.25000000  0.65759708  0.72094856  1.0
  Ir  Ir25  1  0.75000000  0.33363716  0.27978081  1.0
  Ir  Ir26  1  0.25000000  0.55232147  0.04706336  1.0
  Ir  Ir27  1  0.75000000  0.44849174  0.95034589  1.0
  Ir  Ir28  1  0.25000000  0.06267529  0.27430020  1.0
  Ir  Ir29  1  0.75000000  0.93582912  0.72498473  1.0
  Ir  Ir30  1  0.25000000  0.42321006  0.52964715  1.0
  Ir  Ir31  1  0.75000000  0.57687275  0.47478812  1.0
  Ir  Ir32  1  0.25000000  0.91550718  0.99620196  1.0
  Ir  Ir33  1  0.75000000  0.08270864  0.00304264  1.0
  Ir  Ir34  1  0.25000000  0.73112020  0.40172966  1.0
  Ir  Ir35  1  0.75000000  0.27220255  0.60216533  1.0
  Ir  Ir36  1  0.25000000  0.34460325  0.85585489  1.0
  Ir  Ir37  1  0.75000000  0.65728592  0.14191644  1.0