# generated using pymatgen
data_Zr6AlNiSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.70964908
_cell_length_b   7.70964896
_cell_length_c   3.47717905
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000049
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6AlNiSe
_chemical_formula_sum   'Zr6 Al1 Ni1 Se1'
_cell_volume   178.98922934
_cell_formula_units_Z   1
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  0.24642404  0.99529816  0.00000000  1.0
  Zr  Zr1  1  0.74887412  0.75357596  0.00000000  1.0
  Zr  Zr2  1  0.00470184  0.25112588  0.00000000  1.0
  Zr  Zr3  1  0.59759925  0.01105043  0.50000000  1.0
  Zr  Zr4  1  0.41345118  0.40240075  0.50000000  1.0
  Zr  Zr5  1  0.98894957  0.58654882  0.50000000  1.0
  Al  Al6  1  0.33333300  0.66666700  0.00000000  1.0
  Ni  Ni7  1  0.00000000  0.00000000  0.50000000  1.0
  Se  Se8  1  0.66666700  0.33333300  0.00000000  1.0