# generated using pymatgen
data_AlNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01458415
_cell_length_b   5.01458415
_cell_length_c   47.48139826
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi3
_chemical_formula_sum   'Al10 Ni30'
_cell_volume   1034.00819067
_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  0.337946  0.169742  0.300456  1
  Al  Al2  1  0.671279  0.836408  0.347437  1
  Al  Al3  1  0.004612  0.503075  0.389820  1
  Al  Al4  1  0.337946  0.169742  0.433677  1
  Al  Al5  1  0.671279  0.836408  0.477087  1
  Al  Al6  1  0.004612  0.503075  0.520673  1
  Al  Al7  1  0.337946  0.169742  0.564083  1
  Al  Al8  1  0.671279  0.836408  0.607941  1
  Al  Al9  1  0.004612  0.503075  0.650324  1
  Al  Al10  1  0.337946  0.169742  0.697304  1
  Ni  Ni11  1  0.838143  0.170137  0.304391  1
  Ni  Ni12  1  0.838143  0.669544  0.304391  1
  Ni  Ni13  1  0.337551  0.669544  0.304391  1
  Ni  Ni14  1  0.172674  0.839197  0.346313  1
  Ni  Ni15  1  0.172674  0.335014  0.346313  1
  Ni  Ni16  1  0.668490  0.335014  0.346313  1
  Ni  Ni17  1  0.504124  0.502099  0.390162  1
  Ni  Ni18  1  0.504124  0.003563  0.390162  1
  Ni  Ni19  1  0.005588  0.003563  0.390162  1
  Ni  Ni20  1  0.838091  0.170032  0.433566  1
  Ni  Ni21  1  0.838091  0.669596  0.433566  1
  Ni  Ni22  1  0.337655  0.669596  0.433566  1
  Ni  Ni23  1  0.171220  0.836291  0.477130  1
  Ni  Ni24  1  0.171220  0.336467  0.477130  1
  Ni  Ni25  1  0.671397  0.336467  0.477130  1
  Ni  Ni26  1  0.504671  0.503192  0.520630  1
  Ni  Ni27  1  0.504671  1.003016  0.520630  1
  Ni  Ni28  1  1.004495  1.003016  0.520630  1
  Ni  Ni29  1  0.837801  0.169451  0.564195  1
  Ni  Ni30  1  0.837801  0.669887  0.564195  1
  Ni  Ni31  1  0.338236  0.669887  0.564195  1
  Ni  Ni32  1  0.171767  0.837384  0.607599  1
  Ni  Ni33  1  0.171767  0.335920  0.607599  1
  Ni  Ni34  1  0.670303  0.335920  0.607599  1
  Ni  Ni35  1  0.503218  0.500286  0.651447  1
  Ni  Ni36  1  0.503218  0.004469  0.651447  1
  Ni  Ni37  1  0.007401  0.004469  0.651447  1
  Ni  Ni38  1  0.837748  0.169346  0.693369  1
  Ni  Ni39  1  0.837748  0.669939  0.693369  1
  Ni  Ni40  1  0.338341  0.669939  0.693369  1
