# generated using pymatgen
data_Er5Zr3(ReB6)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.60975627
_cell_length_b   9.02201849
_cell_length_c   11.39658662
_cell_angle_alpha   89.97845887
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er5Zr3(ReB6)4
_chemical_formula_sum   'Er5 Zr3 Re4 B24'
_cell_volume   371.15588996
_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
  Er  Er0  1  0.00000000  0.32215959  0.41315305  1.0
  Er  Er1  1  0.00000000  0.67756052  0.58603806  1.0
  Er  Er2  1  0.00000000  0.82216687  0.08626502  1.0
  Er  Er3  1  0.00000000  0.17836587  0.91434742  1.0
  Er  Er4  1  0.00000000  0.94418373  0.37231937  1.0
  Zr  Zr5  1  0.00000000  0.05646355  0.62971591  1.0
  Zr  Zr6  1  0.00000000  0.44436304  0.12710367  1.0
  Zr  Zr7  1  0.00000000  0.55591213  0.87245100  1.0
  Re  Re8  1  0.00000000  0.63599382  0.31769665  1.0
  Re  Re9  1  0.00000000  0.36046565  0.68240739  1.0
  Re  Re10  1  0.00000000  0.14281765  0.17858499  1.0
  Re  Re11  1  0.00000000  0.85994278  0.81954232  1.0
  B  B12  1  0.50000000  0.55198278  0.43299758  1.0
  B  B13  1  0.50000000  0.44570821  0.56687801  1.0
  B  B14  1  0.50000000  0.05422967  0.06619768  1.0
  B  B15  1  0.50000000  0.94632515  0.93365820  1.0
  B  B16  1  0.50000000  0.74832531  0.41813427  1.0
  B  B17  1  0.50000000  0.24876032  0.58211417  1.0
  B  B18  1  0.50000000  0.25194923  0.08048877  1.0
  B  B19  1  0.50000000  0.74883172  0.91895299  1.0
  B  B20  1  0.50000000  0.79234687  0.26413515  1.0
  B  B21  1  0.50000000  0.20608181  0.73611651  1.0
  B  B22  1  0.50000000  0.29434636  0.23419615  1.0
  B  B23  1  0.50000000  0.70607342  0.76474900  1.0
  B  B24  1  0.50000000  0.62963442  0.18346952  1.0
  B  B25  1  0.50000000  0.37013117  0.81665468  1.0
  B  B26  1  0.50000000  0.13206958  0.31491458  1.0
  B  B27  1  0.50000000  0.86954102  0.68403764  1.0
  B  B28  1  0.50000000  0.98295375  0.21194284  1.0
  B  B29  1  0.50000000  0.01831342  0.78757109  1.0
  B  B30  1  0.50000000  0.48056550  0.28640916  1.0
  B  B31  1  0.50000000  0.51873200  0.71299909  1.0
  B  B32  1  0.50000000  0.60162373  0.02716300  1.0
  B  B33  1  0.50000000  0.39929653  0.97208495  1.0
  B  B34  1  0.50000000  0.10319302  0.47456476  1.0
  B  B35  1  0.50000000  0.89858881  0.52994635  1.0