# generated using pymatgen
data_AlNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03016688
_cell_length_b   5.03016688
_cell_length_c   47.46703872
_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   1040.12984194
_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  0.167686  0.168705  0.304496  1
  Al  Al2  1  0.834353  0.835372  0.347113  1
  Al  Al3  1  0.501019  0.502038  0.390625  1
  Al  Al4  1  0.167686  0.168705  0.434263  1
  Al  Al5  1  0.834353  0.835372  0.477775  1
  Al  Al6  1  0.501019  0.502038  0.521326  1
  Al  Al7  1  0.167686  0.168705  0.564838  1
  Al  Al8  1  0.834353  0.835372  0.608476  1
  Al  Al9  1  0.501019  0.502038  0.651988  1
  Al  Al10  1  0.167686  0.168705  0.694605  1
  Ni  Ni11  1  0.667243  0.169591  0.303919  1
  Ni  Ni12  1  0.667243  0.668262  0.303919  1
  Ni  Ni13  1  0.168571  0.668262  0.303919  1
  Ni  Ni14  1  0.334300  0.835478  0.347376  1
  Ni  Ni15  1  0.334300  0.335319  0.347376  1
  Ni  Ni16  1  0.834458  0.335319  0.347376  1
  Ni  Ni17  1  1.000917  0.502243  0.390737  1
  Ni  Ni18  1  1.000917  1.001936  0.390737  1
  Ni  Ni19  1  0.501224  1.001936  0.390737  1
  Ni  Ni20  1  0.667634  0.168808  0.434239  1
  Ni  Ni21  1  0.667634  0.668653  0.434239  1
  Ni  Ni22  1  0.167789  0.668653  0.434239  1
  Ni  Ni23  1  0.334365  0.835346  0.477785  1
  Ni  Ni24  1  0.334365  0.335385  0.477785  1
  Ni  Ni25  1  0.834327  0.335385  0.477785  1
  Ni  Ni26  1  1.001006  0.502064  0.521316  1
  Ni  Ni27  1  1.001006  1.002025  0.521316  1
  Ni  Ni28  1  0.501045  1.002025  0.521316  1
  Ni  Ni29  1  0.667738  0.168602  0.564862  1
  Ni  Ni30  1  0.667738  0.668757  0.564862  1
  Ni  Ni31  1  0.167582  0.668757  0.564862  1
  Ni  Ni32  1  0.334455  0.835167  0.608363  1
  Ni  Ni33  1  0.334455  0.335474  0.608363  1
  Ni  Ni34  1  0.834148  0.335474  0.608363  1
  Ni  Ni35  1  0.001072  0.501932  0.651725  1
  Ni  Ni36  1  0.001072  0.002091  0.651725  1
  Ni  Ni37  1  0.500913  0.002091  0.651725  1
  Ni  Ni38  1  0.668129  0.167820  0.695182  1
  Ni  Ni39  1  0.668129  0.669148  0.695182  1
  Ni  Ni40  1  0.166800  0.669148  0.695182  1
