# generated using pymatgen
data_Nd2Be23Cu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.38447925
_cell_length_b   7.39859167
_cell_length_c   7.36896080
_cell_angle_alpha   60.35511996
_cell_angle_beta   60.19614123
_cell_angle_gamma   59.79796122
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Be23Cu3
_chemical_formula_sum   'Nd2 Be23 Cu3'
_cell_volume   285.41866482
_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  0.74987069  0.75075683  0.75093391  1.0
  Nd  Nd1  1  0.25156142  0.24906609  0.24924317  1.0
  Be  Be2  1  0.43567354  0.20919562  0.79080438  1.0
  Be  Be3  1  0.43326069  0.79160754  0.56777277  1.0
  Be  Be4  1  0.56001579  0.43566288  0.79565484  1.0
  Be  Be5  1  0.79264000  0.43222723  0.20839246  1.0
  Be  Be6  1  0.79133451  0.20434516  0.56433712  1.0
  Be  Be7  1  0.21024890  0.56390489  0.79209170  1.0
  Be  Be8  1  0.43810009  0.56237066  0.20508035  1.0
  Be  Be9  1  0.56624548  0.20790830  0.43609511  1.0
  Be  Be10  1  0.20555109  0.79491965  0.43762934  1.0
  Be  Be11  1  0.93873002  0.71338996  0.06166567  1.0
  Be  Be12  1  0.71378665  0.93833433  0.28661004  1.0
  Be  Be13  1  0.06318477  0.28531813  0.93784025  1.0
  Be  Be14  1  0.28634215  0.06215975  0.71468187  1.0
  Be  Be15  1  0.71419216  0.06823029  0.93176971  1.0
  Be  Be16  1  0.06397160  0.93323860  0.71580217  1.0
  Be  Be17  1  0.06847216  0.71828650  0.28171350  1.0
  Be  Be18  1  0.28671446  0.71502099  0.93395567  1.0
  Be  Be19  1  0.93248922  0.28069747  0.71930253  1.0
  Be  Be20  1  0.93569112  0.06604433  0.28497901  1.0
  Be  Be21  1  0.28549693  0.93613158  0.06386842  1.0
  Be  Be22  1  0.71301337  0.28419783  0.06676140  1.0
  Be  Be23  1  0.50083473  0.50171362  0.49828638  1.0
  Be  Be24  1  0.00033773  0.99941448  0.00058552  1.0
  Cu  Cu25  1  0.80197188  0.55683771  0.44316229  1.0
  Cu  Cu26  1  0.55951470  0.79935207  0.20064793  1.0
  Cu  Cu27  1  0.20075614  0.43966852  0.56033148  1.0