# generated using pymatgen
data_BeNb6Al8Cu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.68313767
_cell_length_b   8.74946708
_cell_length_c   8.18342101
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.96838134
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeNb6Al8Cu3
_chemical_formula_sum   'Be2 Nb12 Al16 Cu6'
_cell_volume   533.09264881
_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
  Be  Be0  1  0.00000000  0.00000000  0.50000000  1.0
  Be  Be1  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb2  1  0.32579305  0.99233250  0.06313402  1.0
  Nb  Nb3  1  0.67420695  0.00766750  0.93686598  1.0
  Nb  Nb4  1  0.99774072  0.32612870  0.06553115  1.0
  Nb  Nb5  1  0.67420695  0.00766750  0.56313402  1.0
  Nb  Nb6  1  0.99774072  0.32612870  0.43446885  1.0
  Nb  Nb7  1  0.00225928  0.67387130  0.93446885  1.0
  Nb  Nb8  1  0.32579305  0.99233250  0.43686598  1.0
  Nb  Nb9  1  0.00225928  0.67387130  0.56553115  1.0
  Nb  Nb10  1  0.66948179  0.66604203  0.06253540  1.0
  Nb  Nb11  1  0.33051821  0.33395797  0.93746460  1.0
  Nb  Nb12  1  0.33051821  0.33395797  0.56253540  1.0
  Nb  Nb13  1  0.66948179  0.66604203  0.43746460  1.0
  Al  Al14  1  0.34547931  0.84766138  0.75000000  1.0
  Al  Al15  1  0.65303803  0.50430129  0.75000000  1.0
  Al  Al16  1  0.65452069  0.15233862  0.25000000  1.0
  Al  Al17  1  0.34696197  0.49569871  0.25000000  1.0
  Al  Al18  1  0.84450747  0.34304691  0.75000000  1.0
  Al  Al19  1  0.15549253  0.65695309  0.25000000  1.0
  Al  Al20  1  0.33979260  0.66517550  0.50557996  1.0
  Al  Al21  1  0.66020740  0.33482450  0.49442004  1.0
  Al  Al22  1  0.66020740  0.33482450  0.00557996  1.0
  Al  Al23  1  0.33979260  0.66517550  0.99442004  1.0
  Al  Al24  1  0.17933365  0.01011044  0.75000000  1.0
  Al  Al25  1  0.82066635  0.98988956  0.25000000  1.0
  Al  Al26  1  0.00976877  0.18107037  0.75000000  1.0
  Al  Al27  1  0.99023123  0.81892963  0.25000000  1.0
  Al  Al28  1  0.82546944  0.83495496  0.75000000  1.0
  Al  Al29  1  0.17453056  0.16504504  0.25000000  1.0
  Cu  Cu30  1  0.16684637  0.50307942  0.75000000  1.0
  Cu  Cu31  1  0.83315363  0.49692058  0.25000000  1.0
  Cu  Cu32  1  0.50456109  0.67173132  0.75000000  1.0
  Cu  Cu33  1  0.50409101  0.17087885  0.75000000  1.0
  Cu  Cu34  1  0.49543891  0.32826868  0.25000000  1.0
  Cu  Cu35  1  0.49590899  0.82912115  0.25000000  1.0