# generated using pymatgen
data_Zr5AlNi4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.24026748
_cell_length_b   7.24026748
_cell_length_c   6.61255064
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr5AlNi4
_chemical_formula_sum   'Zr10 Al2 Ni8'
_cell_volume   346.63964604
_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
  Zr  Zr0  1  0.32042200  0.82042200  0.25000000  1
  Zr  Zr1  1  0.67957800  0.17957800  0.25000000  1
  Zr  Zr2  1  0.17957800  0.32042200  0.75000000  1
  Zr  Zr3  1  0.82042200  0.67957800  0.75000000  1
  Zr  Zr4  1  0.83873800  0.66126200  0.25000000  1
  Zr  Zr5  1  0.16126200  0.33873800  0.25000000  1
  Zr  Zr6  1  0.66126200  0.16126200  0.75000000  1
  Zr  Zr7  1  0.33873800  0.83873800  0.75000000  1
  Zr  Zr8  1  0.00000000  0.00000000  0.00000000  1
  Zr  Zr9  1  0.50000000  0.50000000  0.50000000  1
  Al  Al10  1  0.00000000  0.00000000  0.50000000  1
  Al  Al11  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni12  1  0.12481500  0.62455000  0.97609500  1
  Ni  Ni13  1  0.87518500  0.37545000  0.97609500  1
  Ni  Ni14  1  0.37518500  0.12455000  0.47609500  1
  Ni  Ni15  1  0.62481500  0.87545000  0.47609500  1
  Ni  Ni16  1  0.87545000  0.37518500  0.52390500  1
  Ni  Ni17  1  0.12455000  0.62481500  0.52390500  1
  Ni  Ni18  1  0.62455000  0.87518500  0.02390500  1
  Ni  Ni19  1  0.37545000  0.12481500  0.02390500  1
