# generated using pymatgen
data_Ba6YNi(BO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.03331835
_cell_length_b   8.03331672
_cell_length_c   8.03331796
_cell_angle_alpha   105.87807108
_cell_angle_beta   105.87806890
_cell_angle_gamma   105.87807017
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba6YNi(BO3)6
_chemical_formula_sum   'Ba6 Y1 Ni1 B6 O18'
_cell_volume   444.30028255
_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
  Ba  Ba0  1  0.34359854  0.73106121  0.82829315  1.0
  Ba  Ba1  1  0.82829315  0.34359854  0.73106121  1.0
  Ba  Ba2  1  0.73106121  0.82829315  0.34359854  1.0
  Ba  Ba3  1  0.65640146  0.26893879  0.17170685  1.0
  Ba  Ba4  1  0.17170685  0.65640146  0.26893879  1.0
  Ba  Ba5  1  0.26893879  0.17170685  0.65640146  1.0
  Y  Y6  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni7  1  0.50000000  0.50000000  0.50000000  1.0
  B  B8  1  0.37001531  0.05979911  0.29888907  1.0
  B  B9  1  0.29888907  0.37001531  0.05979911  1.0
  B  B10  1  0.05979911  0.29888907  0.37001531  1.0
  B  B11  1  0.70111093  0.62998469  0.94020089  1.0
  B  B12  1  0.94020089  0.70111093  0.62998469  1.0
  B  B13  1  0.62998469  0.94020089  0.70111093  1.0
  O  O14  1  0.42895467  0.49351931  0.23612022  1.0
  O  O15  1  0.23612022  0.42895467  0.49351931  1.0
  O  O16  1  0.81828541  0.00101120  0.72834826  1.0
  O  O17  1  0.00101120  0.72834826  0.81828541  1.0
  O  O18  1  0.72834826  0.81828541  0.00101120  1.0
  O  O19  1  0.27165174  0.18171459  0.99898880  1.0
  O  O20  1  0.18171459  0.99898880  0.27165174  1.0
  O  O21  1  0.99898880  0.27165174  0.18171459  1.0
  O  O22  1  0.55855846  0.05896418  0.78877952  1.0
  O  O23  1  0.05896418  0.78877952  0.55855846  1.0
  O  O24  1  0.78877952  0.55855846  0.05896418  1.0
  O  O25  1  0.44144154  0.94103582  0.21122048  1.0
  O  O26  1  0.94103582  0.21122048  0.44144154  1.0
  O  O27  1  0.21122048  0.44144154  0.94103582  1.0
  O  O28  1  0.50648069  0.76387978  0.57104533  1.0
  O  O29  1  0.76387978  0.57104533  0.50648069  1.0
  O  O30  1  0.57104533  0.50648069  0.76387978  1.0
  O  O31  1  0.49351931  0.23612022  0.42895467  1.0