# generated using pymatgen
data_Nd(Al5Re)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.89891393
_cell_length_b   6.89892682
_cell_length_c   9.22143769
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   97.05133230
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd(Al5Re)2
_chemical_formula_sum   'Nd2 Al20 Re4'
_cell_volume   435.57571631
_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  0.87445710  0.12558643  0.75000000  1.0
  Nd  Nd1  1  0.12554290  0.87441357  0.25000000  1.0
  Al  Al2  1  0.59673547  0.86392293  0.25000000  1.0
  Al  Al3  1  0.78520118  0.52566310  0.25000000  1.0
  Al  Al4  1  0.15536035  0.84464320  0.90216416  1.0
  Al  Al5  1  0.40326453  0.13607707  0.75000000  1.0
  Al  Al6  1  0.62397736  0.37603025  0.96292479  1.0
  Al  Al7  1  0.84463965  0.15535680  0.40216416  1.0
  Al  Al8  1  0.77114108  0.77114378  0.00000114  1.0
  Al  Al9  1  0.86392213  0.59673758  0.75000000  1.0
  Al  Al10  1  0.84463965  0.15535680  0.09783584  1.0
  Al  Al11  1  0.21479882  0.47433690  0.75000000  1.0
  Al  Al12  1  0.15536035  0.84464320  0.59783584  1.0
  Al  Al13  1  0.77114108  0.77114378  0.49999886  1.0
  Al  Al14  1  0.47431685  0.21479296  0.25000000  1.0
  Al  Al15  1  0.62397736  0.37603025  0.53707521  1.0
  Al  Al16  1  0.22885892  0.22885622  0.50000114  1.0
  Al  Al17  1  0.37602264  0.62396975  0.46292479  1.0
  Al  Al18  1  0.13607787  0.40326242  0.25000000  1.0
  Al  Al19  1  0.52568315  0.78520704  0.75000000  1.0
  Al  Al20  1  0.37602264  0.62396975  0.03707521  1.0
  Al  Al21  1  0.22885892  0.22885622  0.99999886  1.0
  Re  Re22  1  0.50000000  0.00000000  0.00000000  1.0
  Re  Re23  1  0.50000000  0.00000000  0.50000000  1.0
  Re  Re24  1  0.00000000  0.50000000  0.00000000  1.0
  Re  Re25  1  0.00000000  0.50000000  0.50000000  1.0