# generated using pymatgen
data_Pr11Th(Si7Br3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.11821205
_cell_length_b   11.75508174
_cell_length_c   16.67098193
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr11Th(Si7Br3)2
_chemical_formula_sum   'Pr11 Th1 Si14 Br6'
_cell_volume   807.04089047
_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  0.50000000  0.34224147  0.50000000  1.0
  Pr  Pr1  1  0.00000000  0.65782142  0.00000000  1.0
  Pr  Pr2  1  0.50000000  0.35786442  0.75580689  1.0
  Pr  Pr3  1  0.00000000  0.64163544  0.74321661  1.0
  Pr  Pr4  1  0.50000000  0.35786442  0.24419311  1.0
  Pr  Pr5  1  0.00000000  0.64163544  0.25678339  1.0
  Pr  Pr6  1  0.50000000  0.06510561  0.88021823  1.0
  Pr  Pr7  1  0.00000000  0.93432406  0.61923527  1.0
  Pr  Pr8  1  0.50000000  0.06510561  0.11978177  1.0
  Pr  Pr9  1  0.00000000  0.93432406  0.38076473  1.0
  Pr  Pr10  1  0.50000000  0.35691790  0.00000000  1.0
  Th  Th11  1  0.00000000  0.64417012  0.50000000  1.0
  Si  Si12  1  0.00000000  0.15193275  0.00000000  1.0
  Si  Si13  1  0.50000000  0.84806365  0.50000000  1.0
  Si  Si14  1  0.50000000  0.56630974  0.87633683  1.0
  Si  Si15  1  0.00000000  0.43506110  0.62299121  1.0
  Si  Si16  1  0.50000000  0.56630974  0.12366317  1.0
  Si  Si17  1  0.00000000  0.43506110  0.37700879  1.0
  Si  Si18  1  0.00000000  0.25399038  0.87465817  1.0
  Si  Si19  1  0.50000000  0.74561937  0.62481465  1.0
  Si  Si20  1  0.00000000  0.25399038  0.12534183  1.0
  Si  Si21  1  0.50000000  0.74561937  0.37518535  1.0
  Si  Si22  1  0.00000000  0.45852955  0.87612358  1.0
  Si  Si23  1  0.50000000  0.54093580  0.62310726  1.0
  Si  Si24  1  0.50000000  0.54093580  0.37689274  1.0
  Si  Si25  1  0.00000000  0.45852955  0.12387642  1.0
  Br  Br26  1  0.50000000  0.10875159  0.69279217  1.0
  Br  Br27  1  0.00000000  0.89140259  0.80684732  1.0
  Br  Br28  1  0.00000000  0.13864961  0.50000000  1.0
  Br  Br29  1  0.50000000  0.86113877  0.00000000  1.0
  Br  Br30  1  0.50000000  0.10875159  0.30720783  1.0
  Br  Br31  1  0.00000000  0.89140259  0.19315268  1.0