# generated using pymatgen
data_Zr5Se8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.11200017
_cell_length_b   15.11359481
_cell_length_c   7.10838637
_cell_angle_alpha   74.83861612
_cell_angle_beta   89.96167159
_cell_angle_gamma   82.76524344
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr5Se8
_chemical_formula_sum   'Zr5 Se8'
_cell_volume   422.75412392
_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  0.78000100  0.43793200  0.46267400  1.0
  Zr  Zr1  1  0.95547400  0.09248700  0.60737500  1.0
  Zr  Zr2  1  0.45308200  0.09434600  0.12399800  1.0
  Zr  Zr3  1  0.19993500  0.60496300  0.51397200  1.0
  Zr  Zr4  1  0.70253600  0.60305700  0.04637200  1.0
  Se  Se5  1  0.25180400  0.49881300  0.23119800  1.0
  Se  Se6  1  0.73920100  0.52030800  0.74678800  1.0
  Se  Se7  1  0.49509300  0.00785400  0.50523100  1.0
  Se  Se8  1  0.98960500  0.01752900  0.98302000  1.0
  Se  Se9  1  0.37064100  0.25784000  0.03864800  1.0
  Se  Se10  1  0.86627600  0.26225900  0.53761200  1.0
  Se  Se11  1  0.61451800  0.76669500  0.95548000  1.0
  Se  Se12  1  0.11528300  0.76891600  0.44778400  1.0