# generated using pymatgen
data_Pr12Ga3SnI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.01895690
_cell_length_b   11.01895704
_cell_length_c   10.91000457
_cell_angle_alpha   109.27104512
_cell_angle_beta   109.27104538
_cell_angle_gamma   109.67065171
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr12Ga3SnI12
_chemical_formula_sum   'Pr12 Ga3 Sn1 I12'
_cell_volume   1022.23548930
_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
  Pr  Pr0  1  0.02862085  0.26431142  0.01431142  1.0
  Pr  Pr1  1  0.76223486  0.01963650  0.49550139  1.0
  Pr  Pr2  1  0.25740164  0.73776514  0.23326753  1.0
  Pr  Pr3  1  0.48036350  0.73776514  0.00449861  1.0
  Pr  Pr4  1  0.76223486  0.24259836  0.26673247  1.0
  Pr  Pr5  1  0.01562300  0.48437700  0.75000000  1.0
  Pr  Pr6  1  0.23568858  0.26431142  0.75000000  1.0
  Pr  Pr7  1  0.48036350  0.24259836  0.47586689  1.0
  Pr  Pr8  1  0.46875600  0.48437700  0.23437700  1.0
  Pr  Pr9  1  0.25740164  0.01963650  0.02413311  1.0
  Pr  Pr10  1  0.01562300  0.03124400  0.26562300  1.0
  Pr  Pr11  1  0.23568858  0.47137915  0.48568858  1.0
  Ga  Ga12  1  0.24963056  0.49926112  0.99963056  1.0
  Ga  Ga13  1  0.24963056  0.25036944  0.25000000  1.0
  Ga  Ga14  1  0.00073888  0.25036944  0.50036944  1.0
  Sn  Sn15  1  0.50000000  0.00000000  0.25000000  1.0
  I  I16  1  0.75639845  0.74360155  0.25000000  1.0
  I  I17  1  0.99147587  0.50852413  0.25000000  1.0
  I  I18  1  0.24909970  0.75735624  0.74240151  1.0
  I  I19  1  0.75639845  0.51279789  0.50639845  1.0
  I  I20  1  0.50825654  0.25090030  0.99330182  1.0
  I  I21  1  0.74264376  0.99174346  0.98504427  1.0
  I  I22  1  0.99147587  0.98295074  0.74147587  1.0
  I  I23  1  0.51704926  0.50852413  0.75852413  1.0
  I  I24  1  0.24909970  0.99174346  0.50669818  1.0
  I  I25  1  0.74264376  0.25090030  0.75759849  1.0
  I  I26  1  0.50825654  0.75735624  0.51495573  1.0
  I  I27  1  0.98720211  0.74360155  0.99360155  1.0