# generated using pymatgen
data_Lu(NbRe6)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.40114079
_cell_length_b   8.40112930
_cell_length_c   8.40114571
_cell_angle_alpha   109.47125794
_cell_angle_beta   109.47147468
_cell_angle_gamma   109.47109946
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu(NbRe6)4
_chemical_formula_sum   'Lu1 Nb4 Re24'
_cell_volume   456.44835497
_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
  Lu  Lu0  1  0.00000000  0.00000000  0.99999800  1.0
  Nb  Nb1  1  0.37034126  0.37034326  0.37034226  1.0
  Nb  Nb2  1  0.00000200  0.62966374  0.00000100  1.0
  Nb  Nb3  1  0.62966074  0.99999900  0.99999900  1.0
  Nb  Nb4  1  0.99999800  0.99999800  0.62965674  1.0
  Re  Re5  1  0.99999900  0.39974196  0.68165525  1.0
  Re  Re6  1  0.28191129  0.60025804  0.60025704  1.0
  Re  Re7  1  0.71809071  0.31834575  0.31834775  1.0
  Re  Re8  1  0.31834875  0.71808871  0.31834475  1.0
  Re  Re9  1  0.68165125  0.99999800  0.39974196  1.0
  Re  Re10  1  0.99999700  0.68165225  0.39973996  1.0
  Re  Re11  1  0.60025804  0.60025804  0.28190929  1.0
  Re  Re12  1  0.80470626  0.80470926  0.18245898  1.0
  Re  Re13  1  0.37774972  0.19529174  0.00000200  1.0
  Re  Re14  1  0.19528974  0.37774672  0.00000100  1.0
  Re  Re15  1  0.62225328  0.81754202  0.62225128  1.0
  Re  Re16  1  0.37774672  0.99999700  0.19528774  1.0
  Re  Re17  1  0.00000100  0.37774772  0.19528874  1.0
  Re  Re18  1  0.81754102  0.62224928  0.62225028  1.0
  Re  Re19  1  0.18245798  0.80470926  0.80471126  1.0
  Re  Re20  1  0.80470826  0.18245898  0.80470926  1.0
  Re  Re21  1  0.19528974  0.00000000  0.37774672  1.0
  Re  Re22  1  0.99999600  0.19529074  0.37774572  1.0
  Re  Re23  1  0.62225528  0.62225328  0.81754602  1.0
  Re  Re24  1  0.39974396  0.99999900  0.68165425  1.0
  Re  Re25  1  0.60025904  0.28191129  0.60025804  1.0
  Re  Re26  1  0.68165525  0.39974596  0.00000300  1.0
  Re  Re27  1  0.39974396  0.68165325  0.00000100  1.0
  Re  Re28  1  0.31834475  0.31834675  0.71809071  1.0