# generated using pymatgen
data_Mn4CuNiSe8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.36971545
_cell_length_b   7.36971426
_cell_length_c   7.36971541
_cell_angle_alpha   59.99999947
_cell_angle_beta   60.00000481
_cell_angle_gamma   59.99999787
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn4CuNiSe8
_chemical_formula_sum   'Mn4 Cu1 Ni1 Se8'
_cell_volume   283.03301376
_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
  Mn  Mn0  1  0.12463329  0.62512224  0.62512224  1.0
  Mn  Mn1  1  0.62512224  0.12463329  0.62512224  1.0
  Mn  Mn2  1  0.62512224  0.62512224  0.12463329  1.0
  Mn  Mn3  1  0.62512224  0.62512224  0.62512224  1.0
  Cu  Cu4  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni5  1  0.25000000  0.25000000  0.25000000  1.0
  Se  Se6  1  0.39302599  0.86899167  0.86899167  1.0
  Se  Se7  1  0.86899167  0.39302599  0.86899167  1.0
  Se  Se8  1  0.86899167  0.86899167  0.39302599  1.0
  Se  Se9  1  0.86899167  0.86899167  0.86899167  1.0
  Se  Se10  1  0.86135015  0.37954995  0.37954995  1.0
  Se  Se11  1  0.37954995  0.86135015  0.37954995  1.0
  Se  Se12  1  0.37954995  0.37954995  0.86135015  1.0
  Se  Se13  1  0.37954995  0.37954995  0.37954995  1.0