# generated using pymatgen
data_ErPuReB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.68229078
_cell_length_b   9.13251321
_cell_length_c   11.50962417
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErPuReB6
_chemical_formula_sum   'Er4 Pu4 Re4 B24'
_cell_volume   387.05219265
_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
  Er  Er0  1  0.00000000  0.94399964  0.37268605  1.0
  Er  Er1  1  0.00000000  0.05600036  0.62731395  1.0
  Er  Er2  1  0.00000000  0.44399964  0.12731395  1.0
  Er  Er3  1  0.00000000  0.55600036  0.87268605  1.0
  Pu  Pu4  1  0.00000000  0.32114687  0.41424088  1.0
  Pu  Pu5  1  0.00000000  0.67885313  0.58575912  1.0
  Pu  Pu6  1  0.00000000  0.82114687  0.08575912  1.0
  Pu  Pu7  1  0.00000000  0.17885313  0.91424088  1.0
  Re  Re8  1  0.00000000  0.63885095  0.32045573  1.0
  Re  Re9  1  0.00000000  0.36114905  0.67954427  1.0
  Re  Re10  1  0.00000000  0.13885095  0.17954427  1.0
  Re  Re11  1  0.00000000  0.86114905  0.82045573  1.0
  B  B12  1  0.50000000  0.55375091  0.43284958  1.0
  B  B13  1  0.50000000  0.44624909  0.56715042  1.0
  B  B14  1  0.50000000  0.05375091  0.06715042  1.0
  B  B15  1  0.50000000  0.94624909  0.93284958  1.0
  B  B16  1  0.50000000  0.74884410  0.41898915  1.0
  B  B17  1  0.50000000  0.25115590  0.58101085  1.0
  B  B18  1  0.50000000  0.24884410  0.08101085  1.0
  B  B19  1  0.50000000  0.75115590  0.91898915  1.0
  B  B20  1  0.50000000  0.79277567  0.26558291  1.0
  B  B21  1  0.50000000  0.20722433  0.73441709  1.0
  B  B22  1  0.50000000  0.29277567  0.23441709  1.0
  B  B23  1  0.50000000  0.70722433  0.76558291  1.0
  B  B24  1  0.50000000  0.63203880  0.18525746  1.0
  B  B25  1  0.50000000  0.36796120  0.81474254  1.0
  B  B26  1  0.50000000  0.13203880  0.31474254  1.0
  B  B27  1  0.50000000  0.86796120  0.68525746  1.0
  B  B28  1  0.50000000  0.98268746  0.21315135  1.0
  B  B29  1  0.50000000  0.01731254  0.78684865  1.0
  B  B30  1  0.50000000  0.48268746  0.28684865  1.0
  B  B31  1  0.50000000  0.51731254  0.71315135  1.0
  B  B32  1  0.50000000  0.60494021  0.02908438  1.0
  B  B33  1  0.50000000  0.39505979  0.97091562  1.0
  B  B34  1  0.50000000  0.10494021  0.47091562  1.0
  B  B35  1  0.50000000  0.89505979  0.52908438  1.0