# generated using pymatgen
data_Cr3Cu2NiSe8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.31514598
_cell_length_b   7.31514598
_cell_length_c   7.31514576
_cell_angle_alpha   59.76839582
_cell_angle_beta   59.76839582
_cell_angle_gamma   59.76838722
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr3Cu2NiSe8
_chemical_formula_sum   'Cr3 Cu2 Ni1 Se8'
_cell_volume   275.33671476
_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
  Cr  Cr0  1  0.00000000  0.50000000  0.50000000  1.0
  Cr  Cr1  1  0.50000000  0.50000000  0.00000000  1.0
  Cr  Cr2  1  0.50000000  0.00000000  0.50000000  1.0
  Cu  Cu3  1  0.12500600  0.12500600  0.12500600  1.0
  Cu  Cu4  1  0.87499400  0.87499400  0.87499400  1.0
  Ni  Ni5  1  0.50000000  0.50000000  0.50000000  1.0
  Se  Se6  1  0.25793900  0.25793900  0.25793900  1.0
  Se  Se7  1  0.72484500  0.25921600  0.25921600  1.0
  Se  Se8  1  0.25921600  0.25921600  0.72484500  1.0
  Se  Se9  1  0.25921600  0.72484500  0.25921600  1.0
  Se  Se10  1  0.74206100  0.74206100  0.74206100  1.0
  Se  Se11  1  0.27515500  0.74078400  0.74078400  1.0
  Se  Se12  1  0.74078400  0.74078400  0.27515500  1.0
  Se  Se13  1  0.74078400  0.27515500  0.74078400  1.0