# generated using pymatgen
data_Mg(ZrSe2)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.56875116
_cell_length_b   7.56875116
_cell_length_c   12.99179749
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998696
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(ZrSe2)8
_chemical_formula_sum   'Mg1 Zr8 Se16'
_cell_volume   644.53778941
_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
  Mg  Mg0  1  0.00000000  0.00000000  0.00000000  1.0
  Zr  Zr1  1  0.50246947  0.49753053  0.74916025  1.0
  Zr  Zr2  1  0.49753053  0.50246947  0.25083975  1.0
  Zr  Zr3  1  0.50246947  0.00493894  0.74916025  1.0
  Zr  Zr4  1  0.49753053  0.99506106  0.25083975  1.0
  Zr  Zr5  1  0.99506106  0.49753053  0.74916025  1.0
  Zr  Zr6  1  0.00493894  0.50246947  0.25083975  1.0
  Zr  Zr7  1  0.00000000  0.00000000  0.73950645  1.0
  Zr  Zr8  1  0.00000000  0.00000000  0.26049355  1.0
  Se  Se9  1  0.83499176  0.66998552  0.12753914  1.0
  Se  Se10  1  0.83139082  0.66278163  0.62521619  1.0
  Se  Se11  1  0.83499176  0.16500824  0.12753914  1.0
  Se  Se12  1  0.83139082  0.16860918  0.62521619  1.0
  Se  Se13  1  0.33333300  0.66666700  0.12690364  1.0
  Se  Se14  1  0.33333300  0.66666700  0.63167320  1.0
  Se  Se15  1  0.33001448  0.16500824  0.12753914  1.0
  Se  Se16  1  0.33721837  0.16860918  0.62521619  1.0
  Se  Se17  1  0.66998552  0.83499176  0.87246086  1.0
  Se  Se18  1  0.66278163  0.83139082  0.37478381  1.0
  Se  Se19  1  0.66666700  0.33333300  0.87309636  1.0
  Se  Se20  1  0.66666700  0.33333300  0.36832680  1.0
  Se  Se21  1  0.16500824  0.83499176  0.87246086  1.0
  Se  Se22  1  0.16860918  0.83139082  0.37478381  1.0
  Se  Se23  1  0.16500824  0.33001448  0.87246086  1.0
  Se  Se24  1  0.16860918  0.33721837  0.37478381  1.0