# generated using pymatgen
data_YbY6NiCl12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.73484057
_cell_length_b   8.73483945
_cell_length_c   8.73483924
_cell_angle_alpha   106.67892141
_cell_angle_beta   106.67891893
_cell_angle_gamma   106.67891089
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbY6NiCl12
_chemical_formula_sum   'Yb1 Y6 Ni1 Cl12'
_cell_volume   559.81261287
_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
  Yb  Yb0  1  0.50000000  0.50000000  0.50000000  1.0
  Y  Y1  1  0.11144956  0.02202441  0.31733025  1.0
  Y  Y2  1  0.02202441  0.31733025  0.11144956  1.0
  Y  Y3  1  0.31733025  0.11144956  0.02202441  1.0
  Y  Y4  1  0.88854944  0.97797559  0.68266975  1.0
  Y  Y5  1  0.97797559  0.68266975  0.88854944  1.0
  Y  Y6  1  0.68266975  0.88854944  0.97797559  1.0
  Ni  Ni7  1  0.00000000  0.00000000  0.00000000  1.0
  Cl  Cl8  1  0.07222502  0.67604494  0.21567759  1.0
  Cl  Cl9  1  0.67604494  0.21567759  0.07222502  1.0
  Cl  Cl10  1  0.21567759  0.07222502  0.67604494  1.0
  Cl  Cl11  1  0.92777498  0.32395506  0.78432241  1.0
  Cl  Cl12  1  0.32395506  0.78432241  0.92777498  1.0
  Cl  Cl13  1  0.78432241  0.92777498  0.32395506  1.0
  Cl  Cl14  1  0.45921064  0.16421002  0.37455093  1.0
  Cl  Cl15  1  0.16421002  0.37455093  0.45921064  1.0
  Cl  Cl16  1  0.37455093  0.45921064  0.16421002  1.0
  Cl  Cl17  1  0.54078936  0.83578998  0.62544907  1.0
  Cl  Cl18  1  0.83578998  0.62544907  0.54078936  1.0
  Cl  Cl19  1  0.62544907  0.54078936  0.83578998  1.0