# generated using pymatgen
data_Zr4CuSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.36734873
_cell_length_b   5.36734971
_cell_length_c   5.36734953
_cell_angle_alpha   104.99120355
_cell_angle_beta   104.99120535
_cell_angle_gamma   118.85916963
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr4CuSe
_chemical_formula_sum   'Zr4 Cu1 Se1'
_cell_volume   116.59889102
_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  0.40525351  0.90525351  0.81050702  1.0
  Zr  Zr1  1  0.09474649  0.59474649  0.18949298  1.0
  Zr  Zr2  1  0.59474649  0.40525351  0.50000000  1.0
  Zr  Zr3  1  0.90525351  0.09474649  0.50000000  1.0
  Cu  Cu4  1  0.50000000  0.50000000  0.00000000  1.0
  Se  Se5  1  0.00000000  0.00000000  0.00000000  1.0