# generated using pymatgen
data_Nd4BeB15Ru14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44254772
_cell_length_b   6.46905836
_cell_length_c   10.05591873
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.03180311
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd4BeB15Ru14
_chemical_formula_sum   'Nd4 Be1 B15 Ru14'
_cell_volume   419.10264378
_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  0.73324762  0.87727622  0.00093248  1.0
  Nd  Nd1  1  0.12703607  0.73479168  0.49824116  1.0
  Nd  Nd2  1  0.87296393  0.26520832  0.49824116  1.0
  Nd  Nd3  1  0.26675238  0.12272378  0.00093248  1.0
  Be  Be4  1  0.50000000  0.50000000  0.34986942  1.0
  B  B5  1  0.50000000  0.00000000  0.58974487  1.0
  B  B6  1  0.50000000  0.00000000  0.41017270  1.0
  B  B7  1  0.89555852  0.27617164  0.17098775  1.0
  B  B8  1  0.10337520  0.72460503  0.83028315  1.0
  B  B9  1  0.50000000  0.50000000  0.84086747  1.0
  B  B10  1  0.27366414  0.10081743  0.67219315  1.0
  B  B11  1  0.10444148  0.72382836  0.17098775  1.0
  B  B12  1  0.27664431  0.10517134  0.32764935  1.0
  B  B13  1  0.89662480  0.27539497  0.83028315  1.0
  B  B14  1  0.50000000  0.50000000  0.65504957  1.0
  B  B15  1  0.50000000  0.50000000  0.15785598  1.0
  B  B16  1  0.00000000  0.50000000  0.91054818  1.0
  B  B17  1  0.72633586  0.89918257  0.67219315  1.0
  B  B18  1  0.72335569  0.89482866  0.32764935  1.0
  B  B19  1  0.00000000  0.50000000  0.08778209  1.0
  Ru  Ru20  1  0.20501328  0.39941187  0.75341531  1.0
  Ru  Ru21  1  0.38800620  0.27596989  0.50441567  1.0
  Ru  Ru22  1  0.40041757  0.79814516  0.24992545  1.0
  Ru  Ru23  1  0.20205868  0.39812414  0.24369023  1.0
  Ru  Ru24  1  0.61199380  0.72403011  0.50441567  1.0
  Ru  Ru25  1  0.59989155  0.20487859  0.74771422  1.0
  Ru  Ru26  1  0.28543771  0.60052995  0.99913085  1.0
  Ru  Ru27  1  0.71456229  0.39947005  0.99913085  1.0
  Ru  Ru28  1  0.79794132  0.60187586  0.24369023  1.0
  Ru  Ru29  1  0.79498672  0.60058813  0.75341531  1.0
  Ru  Ru30  1  0.40010845  0.79512141  0.74771422  1.0
  Ru  Ru31  1  0.00000000  0.00000000  0.24848370  1.0
  Ru  Ru32  1  0.59958243  0.20185484  0.24992545  1.0
  Ru  Ru33  1  0.00000000  0.00000000  0.75247050  1.0