# generated using pymatgen
data_Li6LaTh5Hg12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13154895
_cell_length_b   7.27415524
_cell_length_c   15.55456751
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00036564
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6LaTh5Hg12
_chemical_formula_sum   'Li6 La1 Th5 Hg12'
_cell_volume   580.61597566
_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  0.00001835  0.50000000  0.00135010  1.0
  Li  Li1  1  0.49953796  0.00000000  0.16908035  1.0
  Li  Li2  1  0.99975776  0.50000000  0.33321086  1.0
  Li  Li3  1  0.49996356  0.00000000  0.49741665  1.0
  Li  Li4  1  0.00044087  0.50000000  0.66550142  1.0
  Li  Li5  1  0.50031186  0.00000000  0.83329868  1.0
  La  La6  1  0.50035278  0.50000000  0.83338854  1.0
  Th  Th7  1  0.99996842  0.00000000  0.00351523  1.0
  Th  Th8  1  0.49976169  0.50000000  0.16823110  1.0
  Th  Th9  1  0.99959461  0.00000000  0.33333716  1.0
  Th  Th10  1  0.50001606  0.50000000  0.49843404  1.0
  Th  Th11  1  0.00029576  0.00000000  0.66312882  1.0
  Hg  Hg12  1  0.49997318  0.25298914  0.00178233  1.0
  Hg  Hg13  1  0.49997318  0.74701186  0.00178233  1.0
  Hg  Hg14  1  0.99975511  0.25055074  0.16834853  1.0
  Hg  Hg15  1  0.99975511  0.74944926  0.16834853  1.0
  Hg  Hg16  1  0.49960904  0.24968706  0.33333759  1.0
  Hg  Hg17  1  0.49960904  0.75031394  0.33333759  1.0
  Hg  Hg18  1  0.00000988  0.25058147  0.49833478  1.0
  Hg  Hg19  1  0.00000988  0.74941853  0.49833478  1.0
  Hg  Hg20  1  0.50033001  0.25317386  0.66495139  1.0
  Hg  Hg21  1  0.50033001  0.74682714  0.66495139  1.0
  Hg  Hg22  1  0.00031095  0.23421675  0.83329741  1.0
  Hg  Hg23  1  0.00031095  0.76578325  0.83329741  1.0