# generated using pymatgen
data_AlNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97494091
_cell_length_b   4.97494091
_cell_length_c   46.96630285
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi3
_chemical_formula_sum   'Al10 Ni30'
_cell_volume   1006.68329071
_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  0.167758  0.918849  0.273730  1
  Al  Al2  1  0.834425  0.585516  0.313088  1
  Al  Al3  1  0.501091  0.252182  0.358404  1
  Al  Al4  1  0.167758  0.918849  0.401365  1
  Al  Al5  1  0.834425  0.585516  0.445070  1
  Al  Al6  1  0.501091  0.252182  0.488554  1
  Al  Al7  1  0.167758  0.918849  0.532130  1
  Al  Al8  1  0.834425  0.585516  0.575601  1
  Al  Al9  1  0.501091  0.252182  0.619324  1
  Al  Al10  1  0.167758  0.918849  0.661504  1
  Ni  Ni11  1  0.336808  0.580749  0.314687  1
  Ni  Ni12  1  0.336808  0.087899  0.314687  1
  Ni  Ni13  1  0.829658  0.087899  0.314687  1
  Ni  Ni14  1  1.000575  0.253216  0.357848  1
  Ni  Ni15  1  1.000575  0.751666  0.357848  1
  Ni  Ni16  1  0.502125  0.751666  0.357848  1
  Ni  Ni17  1  0.667971  0.918422  0.401531  1
  Ni  Ni18  1  0.667971  0.419063  0.401531  1
  Ni  Ni19  1  0.167331  0.419063  0.401531  1
  Ni  Ni20  1  0.334356  0.585654  0.445018  1
  Ni  Ni21  1  0.334356  0.085447  0.445018  1
  Ni  Ni22  1  0.834562  0.085447  0.445018  1
  Ni  Ni23  1  0.001119  0.252127  0.488576  1
  Ni  Ni24  1  0.001119  0.752210  0.488576  1
  Ni  Ni25  1  0.501036  0.752210  0.488576  1
  Ni  Ni26  1  0.667728  0.918908  0.532104  1
  Ni  Ni27  1  0.667728  0.418820  0.532104  1
  Ni  Ni28  1  0.167817  0.418820  0.532104  1
  Ni  Ni29  1  0.334532  0.585302  0.575667  1
  Ni  Ni30  1  0.334532  0.085623  0.575667  1
  Ni  Ni31  1  0.834210  0.085623  0.575667  1
  Ni  Ni32  1  1.000628  0.253110  0.619106  1
  Ni  Ni33  1  1.000628  0.751719  0.619106  1
  Ni  Ni34  1  0.502019  0.751719  0.619106  1
  Ni  Ni35  1  0.669005  0.916354  0.663109  1
  Ni  Ni36  1  0.669005  0.420096  0.663109  1
  Ni  Ni37  1  0.165263  0.420096  0.663109  1
  Ni  Ni38  1  0.333685  0.586994  0.705788  1
  Ni  Ni39  1  0.333685  0.084777  0.705788  1
  Ni  Ni40  1  0.835903  0.084777  0.705788  1
