# generated using pymatgen
data_Nd2Al8SiIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.54679554
_cell_length_b   7.52861868
_cell_length_c   9.53462047
_cell_angle_alpha   89.96166887
_cell_angle_beta   89.90539373
_cell_angle_gamma   119.66171303
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Al8SiIr3
_chemical_formula_sum   'Nd4 Al16 Si2 Ir6'
_cell_volume   470.73994738
_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  0.99471345  0.66541035  0.24458493  1.0
  Nd  Nd1  1  0.00528655  0.33458965  0.75541507  1.0
  Nd  Nd2  1  0.67437002  0.99988433  0.24777551  1.0
  Nd  Nd3  1  0.32562998  0.00011567  0.75222449  1.0
  Al  Al4  1  0.13247507  0.13080997  0.25055463  1.0
  Al  Al5  1  0.86752493  0.86919003  0.74944537  1.0
  Al  Al6  1  0.99666009  0.66574897  0.56536006  1.0
  Al  Al7  1  0.33486856  0.00158727  0.42885050  1.0
  Al  Al8  1  0.00333991  0.33425103  0.43463994  1.0
  Al  Al9  1  0.66513144  0.99841273  0.57114950  1.0
  Al  Al10  1  0.66107361  0.99330267  0.92566926  1.0
  Al  Al11  1  0.33892639  0.00669733  0.07433074  1.0
  Al  Al12  1  0.33510082  0.33393348  0.54938778  1.0
  Al  Al13  1  0.66489918  0.66606652  0.45061222  1.0
  Al  Al14  1  0.66144254  0.66504618  0.05149031  1.0
  Al  Al15  1  0.33855746  0.33495382  0.94850969  1.0
  Al  Al16  1  0.34039414  0.54680853  0.24998782  1.0
  Al  Al17  1  0.65960586  0.45319147  0.75001218  1.0
  Al  Al18  1  0.54475781  0.34161779  0.25022575  1.0
  Al  Al19  1  0.45524219  0.65838221  0.74977425  1.0
  Si  Si20  1  0.00573106  0.32886582  0.07252127  1.0
  Si  Si21  1  0.99426894  0.67113418  0.92747873  1.0
  Ir  Ir22  1  0.68795915  0.33726763  0.00126001  1.0
  Ir  Ir23  1  0.31204085  0.66273237  0.99873999  1.0
  Ir  Ir24  1  0.32808525  0.67000672  0.50031823  1.0
  Ir  Ir25  1  0.67191475  0.32999328  0.49968177  1.0
  Ir  Ir26  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir27  1  0.00000000  0.00000000  0.50000000  1.0