# generated using pymatgen
data_Pr12Be2Br17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.38988728
_cell_length_b   11.42212192
_cell_length_c   11.20365353
_cell_angle_alpha   93.51484002
_cell_angle_beta   106.09747244
_cell_angle_gamma   115.83717774
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr12Be2Br17
_chemical_formula_sum   'Pr12 Be2 Br17'
_cell_volume   1015.78405325
_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  0.06975330  0.52571735  0.33209994  1.0
  Pr  Pr1  1  0.98996466  0.81564439  0.56876032  1.0
  Pr  Pr2  1  0.61483931  0.23311902  0.27702668  1.0
  Pr  Pr3  1  0.01003534  0.18435561  0.43123968  1.0
  Pr  Pr4  1  0.24178436  0.67275088  0.01221563  1.0
  Pr  Pr5  1  0.30150268  0.01192485  0.91887586  1.0
  Pr  Pr6  1  0.38516069  0.76688098  0.72297332  1.0
  Pr  Pr7  1  0.93024670  0.47428265  0.66790006  1.0
  Pr  Pr8  1  0.69849732  0.98807515  0.08112414  1.0
  Pr  Pr9  1  0.16127254  0.28701804  0.14297791  1.0
  Pr  Pr10  1  0.75821564  0.32724912  0.98778437  1.0
  Pr  Pr11  1  0.83872746  0.71298196  0.85702209  1.0
  Be  Be12  1  0.10667575  0.73624920  0.78640370  1.0
  Be  Be13  1  0.89332425  0.26375080  0.21359630  1.0
  Br  Br14  1  0.77851023  0.52675864  0.41079698  1.0
  Br  Br15  1  0.62584835  0.42210097  0.74112071  1.0
  Br  Br16  1  0.83802965  0.89576254  0.31524715  1.0
  Br  Br17  1  0.31907217  0.21245314  0.37356104  1.0
  Br  Br18  1  0.16197035  0.10423746  0.68475285  1.0
  Br  Br19  1  0.59305020  0.05938511  0.82028400  1.0
  Br  Br20  1  0.74141082  0.17146014  0.53297200  1.0
  Br  Br21  1  0.54036103  0.67881826  0.95448624  1.0
  Br  Br22  1  0.37415165  0.57789903  0.25887929  1.0
  Br  Br23  1  0.22148977  0.47324136  0.58920302  1.0
  Br  Br24  1  0.05669760  0.37124504  0.89489086  1.0
  Br  Br25  1  0.45963897  0.32118174  0.04551376  1.0
  Br  Br26  1  0.00000000  0.00000000  0.00000000  1.0
  Br  Br27  1  0.25858918  0.82853986  0.46702800  1.0
  Br  Br28  1  0.40694980  0.94061489  0.17971600  1.0
  Br  Br29  1  0.68092783  0.78754686  0.62643896  1.0
  Br  Br30  1  0.94330240  0.62875496  0.10510914  1.0