# generated using pymatgen
data_La12Os(PdI4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.08987632
_cell_length_b   11.02234000
_cell_length_c   11.02233977
_cell_angle_alpha   109.34676954
_cell_angle_beta   109.59540082
_cell_angle_gamma   109.59538186
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La12Os(PdI4)3
_chemical_formula_sum   'La12 Os1 Pd3 I12'
_cell_volume   1035.58216408
_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  0.45902842  0.48649681  0.22435261  1.0
  La  La1  1  0.75000000  0.23130266  0.26869734  1.0
  La  La2  1  0.75000000  0.02015900  0.47984100  1.0
  La  La3  1  0.22984100  0.45968100  0.47984100  1.0
  La  La4  1  0.26532219  0.73785580  0.22435261  1.0
  La  La5  1  0.04097158  0.27564739  0.01350319  1.0
  La  La6  1  0.01869734  0.03739568  0.26869734  1.0
  La  La7  1  0.47253361  0.73785580  0.01350319  1.0
  La  La8  1  0.48130266  0.23130266  0.46260432  1.0
  La  La9  1  0.02746639  0.48649681  0.76214420  1.0
  La  La10  1  0.27015900  0.02015900  0.04031900  1.0
  La  La11  1  0.23467781  0.27564739  0.76214420  1.0
  Os  Os12  1  0.25000000  0.50000000  0.00000000  1.0
  Pd  Pd13  1  0.25000000  0.24842241  0.25157759  1.0
  Pd  Pd14  1  0.50157759  0.00315518  0.25157759  1.0
  Pd  Pd15  1  0.99842241  0.24842241  0.49684482  1.0
  I  I16  1  0.25000000  0.76026818  0.73973182  1.0
  I  I17  1  0.51964300  0.50957173  0.75933541  1.0
  I  I18  1  0.98035700  0.74066459  0.99042827  1.0
  I  I19  1  0.73969141  0.24976368  0.75933541  1.0
  I  I20  1  0.98973182  0.97946563  0.73973182  1.0
  I  I21  1  0.25000000  0.99161075  0.50838925  1.0
  I  I22  1  0.75838925  0.51677751  0.50838925  1.0
  I  I23  1  0.51007126  0.24976368  0.99042827  1.0
  I  I24  1  0.76030859  0.74066459  0.25023632  1.0
  I  I25  1  0.74161075  0.99161075  0.98322249  1.0
  I  I26  1  0.98992874  0.50957173  0.25023632  1.0
  I  I27  1  0.51026818  0.76026818  0.52053437  1.0