# generated using pymatgen
data_Pr3BRuO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.72388612
_cell_length_b   8.72388870
_cell_length_c   5.59225253
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999763
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3BRuO9
_chemical_formula_sum   'Pr6 B2 Ru2 O18'
_cell_volume   368.58488429
_cell_formula_units_Z   2
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  0.35877729  0.08127215  0.19906617  1.0
  Pr  Pr1  1  0.91872885  0.27750513  0.19906617  1.0
  Pr  Pr2  1  0.72249587  0.64122371  0.19906617  1.0
  Pr  Pr3  1  0.27750513  0.35877729  0.69906517  1.0
  Pr  Pr4  1  0.08127215  0.72249587  0.69906517  1.0
  Pr  Pr5  1  0.64122371  0.91872885  0.69906517  1.0
  B  B6  1  0.00000000  0.00000000  0.35807516  1.0
  B  B7  1  0.00000000  0.00000000  0.85807416  1.0
  Ru  Ru8  1  0.33333500  0.66666700  0.24881169  1.0
  Ru  Ru9  1  0.66666500  0.33333200  0.74881269  1.0
  O  O10  1  0.21176671  0.46975838  0.04858867  1.0
  O  O11  1  0.25798967  0.78823129  0.04858867  1.0
  O  O12  1  0.53024062  0.74201033  0.04859067  1.0
  O  O13  1  0.13214564  0.17426319  0.35025299  1.0
  O  O14  1  0.04211755  0.86785536  0.35025299  1.0
  O  O15  1  0.82573681  0.95788245  0.35025299  1.0
  O  O16  1  0.13614925  0.51800470  0.46953022  1.0
  O  O17  1  0.48199430  0.61814355  0.46953022  1.0
  O  O18  1  0.38185545  0.86385075  0.46953022  1.0
  O  O19  1  0.78823129  0.53024162  0.54858767  1.0
  O  O20  1  0.74200933  0.21176971  0.54858967  1.0
  O  O21  1  0.46975838  0.25799067  0.54858967  1.0
  O  O22  1  0.17426419  0.04211855  0.85025399  1.0
  O  O23  1  0.95788145  0.13214564  0.85025399  1.0
  O  O24  1  0.86785536  0.82573581  0.85025399  1.0
  O  O25  1  0.61814455  0.13615025  0.96952922  1.0
  O  O26  1  0.51800570  0.38185545  0.96952922  1.0
  O  O27  1  0.86385075  0.48199530  0.96953022  1.0