# generated using pymatgen
data_La6Cd7Hg16As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.16731824
_cell_length_b   10.16731765
_cell_length_c   10.16731873
_cell_angle_alpha   59.99999962
_cell_angle_beta   60.00000152
_cell_angle_gamma   60.00000273
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La6Cd7Hg16As
_chemical_formula_sum   'La6 Cd7 Hg16 As1'
_cell_volume   743.19753878
_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
  La  La0  1  0.78250681  0.78250681  0.21749319  1.0
  La  La1  1  0.21749319  0.78250681  0.21749319  1.0
  La  La2  1  0.78250681  0.21749319  0.21749319  1.0
  La  La3  1  0.21749319  0.21749319  0.78250681  1.0
  La  La4  1  0.78250681  0.21749319  0.78250681  1.0
  La  La5  1  0.21749319  0.78250681  0.78250681  1.0
  Cd  Cd6  1  0.00000000  0.00000000  0.50000000  1.0
  Cd  Cd7  1  0.50000000  0.00000000  0.50000000  1.0
  Cd  Cd8  1  0.00000000  0.50000000  0.50000000  1.0
  Cd  Cd9  1  0.50000000  0.50000000  0.00000000  1.0
  Cd  Cd10  1  0.00000000  0.50000000  0.00000000  1.0
  Cd  Cd11  1  0.50000000  0.00000000  0.00000000  1.0
  Cd  Cd12  1  0.50000000  0.50000000  0.50000000  1.0
  Hg  Hg13  1  0.84296164  0.84296164  0.47111708  1.0
  Hg  Hg14  1  0.84296164  0.47111708  0.84296164  1.0
  Hg  Hg15  1  0.47111708  0.84296164  0.84296164  1.0
  Hg  Hg16  1  0.84296164  0.84296164  0.84296164  1.0
  Hg  Hg17  1  0.15703836  0.15703836  0.52888292  1.0
  Hg  Hg18  1  0.15703836  0.52888292  0.15703836  1.0
  Hg  Hg19  1  0.52888292  0.15703836  0.15703836  1.0
  Hg  Hg20  1  0.15703836  0.15703836  0.15703836  1.0
  Hg  Hg21  1  0.62279998  0.62279998  0.13159906  1.0
  Hg  Hg22  1  0.62279998  0.13159906  0.62279998  1.0
  Hg  Hg23  1  0.13159906  0.62279998  0.62279998  1.0
  Hg  Hg24  1  0.62279998  0.62279998  0.62279998  1.0
  Hg  Hg25  1  0.37720002  0.37720002  0.86840094  1.0
  Hg  Hg26  1  0.37720002  0.86840094  0.37720002  1.0
  Hg  Hg27  1  0.86840094  0.37720002  0.37720002  1.0
  Hg  Hg28  1  0.37720002  0.37720002  0.37720002  1.0
  As  As29  1  0.00000000  0.00000000  0.00000000  1.0