# generated using pymatgen
data_ZrAlCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14697708
_cell_length_b   5.14482571
_cell_length_c   5.14595524
_cell_angle_alpha   119.81773557
_cell_angle_beta   118.74870733
_cell_angle_gamma   91.22821558
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrAlCu
_chemical_formula_sum   'Zr2 Al2 Cu2'
_cell_volume   97.38109492
_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  0.87502842  0.62495710  0.25005668  1.0
  Zr  Zr1  1  0.12497158  0.37504290  0.74994332  1.0
  Al  Al2  1  0.00000000  0.00000000  0.00000000  1.0
  Al  Al3  1  0.50000000  -0.00000000  0.50000000  1.0
  Cu  Cu4  1  0.50000000  0.00000000  -0.00000000  1.0
  Cu  Cu5  1  0.50000000  0.50000000  0.50000000  1.0