# generated using pymatgen
data_Nd2Be3SiIr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.10814983
_cell_length_b   4.10814983
_cell_length_c   9.44980407
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Be3SiIr4
_chemical_formula_sum   'Nd2 Be3 Si1 Ir4'
_cell_volume   159.48335123
_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  0.00000000  0.50000000  0.25562606  1.0
  Nd  Nd1  1  0.50000000  0.00000000  0.74742420  1.0
  Be  Be2  1  0.00000000  0.00000000  0.50086775  1.0
  Be  Be3  1  0.50000000  0.50000000  0.50086775  1.0
  Be  Be4  1  0.00000000  0.50000000  0.88030639  1.0
  Si  Si5  1  0.50000000  0.00000000  0.12460405  1.0
  Ir  Ir6  1  0.00000000  0.00000000  0.99837540  1.0
  Ir  Ir7  1  0.50000000  0.50000000  0.99837540  1.0
  Ir  Ir8  1  0.00000000  0.50000000  0.61219663  1.0
  Ir  Ir9  1  0.50000000  0.00000000  0.38135738  1.0