# generated using pymatgen
data_Li6ErPu2N6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.96418179
_cell_length_b   5.96418390
_cell_length_c   5.43882375
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001028
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6ErPu2N6
_chemical_formula_sum   'Li6 Er1 Pu2 N6'
_cell_volume   167.54731415
_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
  Li  Li0  1  0.99885483  0.66616090  0.60717162  1.0
  Li  Li1  1  0.33383910  0.33269493  0.60717162  1.0
  Li  Li2  1  0.66730507  0.00114517  0.60717162  1.0
  Li  Li3  1  0.00114517  0.33383910  0.39282838  1.0
  Li  Li4  1  0.66616090  0.66730507  0.39282838  1.0
  Li  Li5  1  0.33269493  0.99885483  0.39282838  1.0
  Er  Er6  1  0.00000000  0.00000000  0.00000000  1.0
  Pu  Pu7  1  0.33333300  0.66666700  0.99888448  1.0
  Pu  Pu8  1  0.66666700  0.33333300  0.00111552  1.0
  N  N9  1  0.00032652  0.65779242  0.22616791  1.0
  N  N10  1  0.34220758  0.34253410  0.22616791  1.0
  N  N11  1  0.65746590  0.99967348  0.22616791  1.0
  N  N12  1  0.99967348  0.34220758  0.77383209  1.0
  N  N13  1  0.65779242  0.65746590  0.77383209  1.0
  N  N14  1  0.34253410  0.00032652  0.77383209  1.0