# generated using pymatgen
data_LiWCl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.28824563
_cell_length_b   9.29329736
_cell_length_c   9.30715228
_cell_angle_alpha   84.17582978
_cell_angle_beta   84.31472588
_cell_angle_gamma   84.27969352
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiWCl6
_chemical_formula_sum   'Li4 W4 Cl24'
_cell_volume   792.03461276
_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  0.33249377  0.33613679  0.33523471  1
  Li  Li1  1  0.16779990  0.66877103  0.16786327  1
  Li  Li2  1  0.16754165  0.16615044  0.66942998  1
  Li  Li3  1  0.66957010  0.16878727  0.16869203  1
  W  W4  1  0.50595037  0.98856132  0.50450494  1
  W  W5  1  0.99886268  0.99979736  0.99906789  1
  W  W6  1  0.50455491  0.50640973  0.98817791  1
  W  W7  1  0.98812479  0.50531921  0.50501886  1
  Cl  Cl8  1  0.93055525  0.26648359  0.56920670  1
  Cl  Cl9  1  0.42588556  0.76795223  0.56973863  1
  Cl  Cl10  1  0.07903433  0.22693947  0.92417260  1
  Cl  Cl11  1  0.56939545  0.42612268  0.76792890  1
  Cl  Cl12  1  0.92014925  0.07614957  0.22917680  1
  Cl  Cl13  1  0.42349505  0.08201604  0.72612832  1
  Cl  Cl14  1  0.56926728  0.93069054  0.26605590  1
  Cl  Cl15  1  0.08071453  0.42759967  0.26846972  1
  Cl  Cl16  1  0.23005613  0.41871702  0.57558191  1
  Cl  Cl17  1  0.22750012  0.92411446  0.07876762  1
  Cl  Cl18  1  0.57553697  0.23068525  0.41944516  1
  Cl  Cl19  1  0.92713001  0.76715602  0.07139069  1
  Cl  Cl20  1  0.76723278  0.56838573  0.42597791  1
  Cl  Cl21  1  0.72887324  0.92539928  0.57901231  1
  Cl  Cl22  1  0.42703201  0.26980217  0.08111103  1
  Cl  Cl23  1  0.26968897  0.08094760  0.42668194  1
  Cl  Cl24  1  0.41958798  0.57614458  0.23006678  1
  Cl  Cl25  1  0.76711660  0.06959218  0.92766843  1
  Cl  Cl26  1  0.08381382  0.72574129  0.42365533  1
  Cl  Cl27  1  0.57973946  0.72875874  0.92537990  1
  Cl  Cl28  1  0.92553397  0.58131156  0.72749496  1
  Cl  Cl29  1  0.72670490  0.42276944  0.08151744  1
  Cl  Cl30  1  0.26558202  0.56872167  0.93070957  1
  Cl  Cl31  1  0.07543616  0.92782906  0.76663286  1
