# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94948436
_cell_length_b   6.82685421
_cell_length_c   46.62954342
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al30 Ni20'
_cell_volume   1575.58467248
_cell_formula_units_Z   10
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
  Al  Al1  1  0.022201  0.642006  0.280621  1
  Al  Al2  1  0.364267  0.058592  0.286672  1
  Al  Al3  1  0.631405  0.851267  0.328658  1
  Al  Al4  1  0.976146  0.199886  0.321093  1
  Al  Al5  1  0.369158  0.494838  0.319488  1
  Al  Al6  1  0.644049  0.374007  0.368773  1
  Al  Al7  1  0.021565  0.702619  0.369367  1
  Al  Al8  1  0.355161  0.028654  0.368384  1
  Al  Al9  1  0.652175  0.877545  0.411674  1
  Al  Al10  1  0.005309  0.205130  0.411039  1
  Al  Al11  1  0.353608  0.529268  0.411238  1
  Al  Al12  1  0.646440  0.377024  0.455501  1
  Al  Al13  1  0.999674  0.703528  0.455704  1
  Al  Al14  1  0.361850  0.033098  0.455739  1
  Al  Al15  1  0.652855  0.877392  0.499369  1
  Al  Al16  1  1.002985  0.204218  0.499419  1
  Al  Al17  1  0.354002  0.530470  0.499353  1
  Al  Al18  1  0.643766  0.376437  0.542589  1
  Al  Al19  1  0.007406  0.704988  0.542309  1
  Al  Al20  1  0.363394  0.033183  0.542364  1
  Al  Al21  1  0.655999  0.886376  0.588430  1
  Al  Al22  1  0.991980  0.203344  0.588790  1
  Al  Al23  1  0.350969  0.533926  0.586309  1
  Al  Al24  1  0.641639  0.372766  0.627675  1
  Al  Al25  1  0.988576  0.722901  0.627937  1
  Al  Al26  1  0.358857  0.029708  0.631892  1
  Al  Al27  1  0.629055  0.926213  0.684713  1
  Al  Al28  1  0.097613  0.233213  0.683467  1
  Al  Al29  1  0.388149  0.597892  0.662372  1
  Al  Al30  1  0.612220  0.402072  0.707389  1
  Ni  Ni31  1  0.849525  0.969176  0.284981  1
  Ni  Ni32  1  0.143320  0.849774  0.324144  1
  Ni  Ni33  1  0.858348  0.537934  0.326889  1
  Ni  Ni34  1  0.151443  0.361596  0.365944  1
  Ni  Ni35  1  0.854405  0.039932  0.367207  1
  Ni  Ni36  1  0.158807  0.869220  0.412836  1
  Ni  Ni37  1  0.847141  0.540125  0.412014  1
  Ni  Ni38  1  0.153100  0.367166  0.455321  1
  Ni  Ni39  1  0.855063  0.042449  0.455287  1
  Ni  Ni40  1  0.159080  0.868632  0.498882  1
  Ni  Ni41  1  0.847745  0.539662  0.499202  1
  Ni  Ni42  1  0.148846  0.364169  0.543818  1
  Ni  Ni43  1  0.855823  0.041921  0.543692  1
  Ni  Ni44  1  0.166358  0.874439  0.585238  1
  Ni  Ni45  1  0.846717  0.544000  0.585225  1
  Ni  Ni46  1  0.142439  0.368336  0.631906  1
  Ni  Ni47  1  0.853935  0.059825  0.637688  1
  Ni  Ni48  1  0.117664  0.875172  0.674782  1
  Ni  Ni49  1  0.864423  0.549884  0.669479  1
  Ni  Ni50  1  0.156392  0.575948  0.708138  1
