# generated using pymatgen
data_PaNbReB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56883026
_cell_length_b   8.99475810
_cell_length_c   11.34991890
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PaNbReB6
_chemical_formula_sum   'Pa4 Nb4 Re4 B24'
_cell_volume   364.34107856
_cell_formula_units_Z   4
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
  Pa  Pa0  1  0.00000000  0.32313899  0.41305345  1.0
  Pa  Pa1  1  0.00000000  0.67686101  0.58694655  1.0
  Pa  Pa2  1  0.00000000  0.82313899  0.08694655  1.0
  Pa  Pa3  1  0.00000000  0.17686101  0.91305345  1.0
  Nb  Nb4  1  0.00000000  0.94640278  0.37543841  1.0
  Nb  Nb5  1  0.00000000  0.05359722  0.62456159  1.0
  Nb  Nb6  1  0.00000000  0.44640278  0.12456159  1.0
  Nb  Nb7  1  0.00000000  0.55359722  0.87543841  1.0
  Re  Re8  1  0.00000000  0.64256594  0.31924415  1.0
  Re  Re9  1  0.00000000  0.35743406  0.68075585  1.0
  Re  Re10  1  0.00000000  0.14256594  0.18075585  1.0
  Re  Re11  1  0.00000000  0.85743406  0.81924415  1.0
  B  B12  1  0.50000000  0.55381887  0.43486422  1.0
  B  B13  1  0.50000000  0.44618113  0.56513578  1.0
  B  B14  1  0.50000000  0.05381887  0.06513578  1.0
  B  B15  1  0.50000000  0.94618113  0.93486422  1.0
  B  B16  1  0.50000000  0.75443819  0.41985700  1.0
  B  B17  1  0.50000000  0.24556181  0.58014300  1.0
  B  B18  1  0.50000000  0.25443819  0.08014300  1.0
  B  B19  1  0.50000000  0.74556181  0.91985700  1.0
  B  B20  1  0.50000000  0.79770934  0.26447476  1.0
  B  B21  1  0.50000000  0.20229066  0.73552524  1.0
  B  B22  1  0.50000000  0.29770934  0.23552524  1.0
  B  B23  1  0.50000000  0.70229066  0.76447476  1.0
  B  B24  1  0.50000000  0.63043909  0.18135347  1.0
  B  B25  1  0.50000000  0.36956091  0.81864653  1.0
  B  B26  1  0.50000000  0.13043909  0.31864653  1.0
  B  B27  1  0.50000000  0.86956091  0.68135347  1.0
  B  B28  1  0.50000000  0.98085025  0.21486098  1.0
  B  B29  1  0.50000000  0.01914975  0.78513902  1.0
  B  B30  1  0.50000000  0.48085025  0.28513902  1.0
  B  B31  1  0.50000000  0.51914975  0.71486098  1.0
  B  B32  1  0.50000000  0.60107264  0.02727302  1.0
  B  B33  1  0.50000000  0.39892736  0.97272698  1.0
  B  B34  1  0.50000000  0.10107264  0.47272698  1.0
  B  B35  1  0.50000000  0.89892736  0.52727302  1.0