# generated using pymatgen
data_La6CoAuI6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.10067011
_cell_length_b   11.10066827
_cell_length_c   10.95558233
_cell_angle_alpha   109.10946390
_cell_angle_beta   109.10946706
_cell_angle_gamma   110.72051231
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La6CoAuI6
_chemical_formula_sum   'La12 Co2 Au2 I12'
_cell_volume   1032.22754951
_cell_formula_units_Z   2
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  0.45452680  0.48514373  0.22103042  1.0
  La  La1  1  0.76411431  0.23349738  0.27896958  1.0
  La  La2  1  0.77064379  0.02943824  0.48902697  1.0
  La  La3  1  0.21838318  0.45958674  0.48902697  1.0
  La  La4  1  0.26650262  0.73588569  0.22103042  1.0
  La  La5  1  0.04041326  0.28161682  0.01097303  1.0
  La  La6  1  0.01485627  0.04547320  0.27896958  1.0
  La  La7  1  0.47056176  0.72935621  0.01097303  1.0
  La  La8  1  0.48531836  0.23531836  0.47063673  1.0
  La  La9  1  0.02437693  0.47562307  0.75000000  1.0
  La  La10  1  0.26468164  0.01468164  0.02936327  1.0
  La  La11  1  0.22562307  0.27437693  0.75000000  1.0
  Co  Co12  1  0.00005714  0.25005714  0.50011427  1.0
  Co  Co13  1  0.24994286  0.49994286  0.99988573  1.0
  Au  Au14  1  0.24890985  0.25109015  0.25000000  1.0
  Au  Au15  1  0.50109015  0.99890985  0.25000000  1.0
  I  I16  1  0.25230977  0.76102707  0.74205247  1.0
  I  I17  1  0.51897560  0.51025930  0.75794753  1.0
  I  I18  1  0.98407827  0.73947080  0.99180758  1.0
  I  I19  1  0.73897293  0.24769023  0.75794753  1.0
  I  I20  1  0.98974070  0.98102440  0.74205247  1.0
  I  I21  1  0.24766222  0.99227068  0.50819242  1.0
  I  I22  1  0.76052920  0.51592173  0.50819242  1.0
  I  I23  1  0.50772932  0.25233778  0.99180758  1.0
  I  I24  1  0.75974931  0.74025069  0.25000000  1.0
  I  I25  1  0.74209893  0.99209893  0.98419586  1.0
  I  I26  1  0.99025069  0.50974931  0.25000000  1.0
  I  I27  1  0.50790107  0.75790107  0.51580414  1.0