# generated using pymatgen
data_LiY(TlCl3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.26833920
_cell_length_b   10.59269566
_cell_length_c   10.23861871
_cell_angle_alpha   89.98581845
_cell_angle_beta   90.00125519
_cell_angle_gamma   89.93178063
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiY(TlCl3)2
_chemical_formula_sum   'Li4 Y4 Tl8 Cl24'
_cell_volume   1113.64750878
_cell_formula_units_Z   4
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  0.50006496  0.00012289  0.99990979  1
  Li  Li1  1  0.49990133  0.50016029  0.50032004  1
  Li  Li2  1  0.99998299  0.00000461  0.50006506  1
  Li  Li3  1  0.99999839  0.49992751  0.00000358  1
  Y  Y4  1  0.99996699  0.00003563  0.00007790  1
  Y  Y5  1  0.99996221  0.49990738  0.50011315  1
  Y  Y6  1  0.49985879  0.00019231  0.50023754  1
  Y  Y7  1  0.50005869  0.50028769  0.99987449  1
  Tl  Tl8  1  0.24011312  0.24529549  0.24987534  1
  Tl  Tl9  1  0.25476695  0.24618656  0.75167068  1
  Tl  Tl10  1  0.24000502  0.74494752  0.74988620  1
  Tl  Tl11  1  0.25453702  0.74676144  0.25109280  1
  Tl  Tl12  1  0.74538072  0.25320771  0.74918468  1
  Tl  Tl13  1  0.75896873  0.25554922  0.25056610  1
  Tl  Tl14  1  0.74458596  0.75393975  0.24903827  1
  Tl  Tl15  1  0.76029123  0.75492516  0.75046338  1
  Cl  Cl16  1  0.50191409  0.25137388  0.97086486  1
  Cl  Cl17  1  0.55005197  0.02474890  0.24772404  1
  Cl  Cl18  1  0.25276670  0.00073938  0.05090663  1
  Cl  Cl19  1  0.99960260  0.24973800  0.00244003  1
  Cl  Cl20  1  0.44929834  0.97581653  0.75263841  1
  Cl  Cl21  1  0.74713960  0.99962861  0.94900006  1
  Cl  Cl22  1  0.50000999  0.75129032  0.47129381  1
  Cl  Cl23  1  0.55057985  0.52502188  0.74755412  1
  Cl  Cl24  1  0.25271484  0.49941899  0.55133720  1
  Cl  Cl25  1  0.00049605  0.74964404  0.50284873  1
  Cl  Cl26  1  0.44973362  0.47539079  0.25229937  1
  Cl  Cl27  1  0.74714768  0.50088452  0.44901100  1
  Cl  Cl28  1  0.99892179  0.25025299  0.49750867  1
  Cl  Cl29  1  0.05056969  0.00000931  0.74680529  1
  Cl  Cl30  1  0.75242686  0.99942882  0.55130667  1
  Cl  Cl31  1  0.49935578  0.24907730  0.52931199  1
  Cl  Cl32  1  0.94887465  0.99989626  0.25314545  1
  Cl  Cl33  1  0.24728516  0.00093230  0.44900302  1
  Cl  Cl34  1  0.00007847  0.75031235  0.99763650  1
  Cl  Cl35  1  0.05099452  0.50019471  0.24690209  1
  Cl  Cl36  1  0.75255399  0.50075945  0.05136536  1
  Cl  Cl37  1  0.49792459  0.74915536  0.02912389  1
  Cl  Cl38  1  0.94918356  0.49966364  0.75334619  1
  Cl  Cl39  1  0.24748349  0.49978252  0.94864563  1
