# generated using pymatgen
data_LuPa9(Re3C8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.39908928
_cell_length_b   11.39908928
_cell_length_c   3.39029565
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.91640282
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuPa9(Re3C8)2
_chemical_formula_sum   'Lu1 Pa9 Re6 C16'
_cell_volume   440.53195892
_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  0.50000000  0.00000000  1.0
  Pa  Pa1  1  0.27041773  0.54397976  0.50000000  1.0
  Pa  Pa2  1  0.72958227  0.45602024  0.50000000  1.0
  Pa  Pa3  1  0.54415526  0.72507373  0.50000000  1.0
  Pa  Pa4  1  0.77492627  0.95584474  0.50000000  1.0
  Pa  Pa5  1  0.22507373  0.04415526  0.50000000  1.0
  Pa  Pa6  1  0.95602024  0.22958227  0.50000000  1.0
  Pa  Pa7  1  0.45584474  0.27492627  0.50000000  1.0
  Pa  Pa8  1  0.50000000  0.00000000  0.00000000  1.0
  Pa  Pa9  1  0.04397976  0.77041773  0.50000000  1.0
  Re  Re10  1  0.20235504  0.29764496  0.00000000  1.0
  Re  Re11  1  0.70103391  0.20103391  0.00000000  1.0
  Re  Re12  1  0.29896609  0.79896609  0.00000000  1.0
  Re  Re13  1  0.50000000  0.50000000  0.00000000  1.0
  Re  Re14  1  0.79764496  0.70235504  0.00000000  1.0
  Re  Re15  1  0.00000000  0.00000000  0.00000000  1.0
  C  C16  1  0.34538464  0.40333420  0.00000000  1.0
  C  C17  1  0.61784594  0.11784594  0.50000000  1.0
  C  C18  1  0.90333420  0.84538464  0.00000000  1.0
  C  C19  1  0.65210505  0.84789495  0.00000000  1.0
  C  C20  1  0.34789495  0.15210505  0.00000000  1.0
  C  C21  1  0.11708389  0.38291611  0.50000000  1.0
  C  C22  1  0.15275547  0.90148070  0.00000000  1.0
  C  C23  1  0.84859297  0.34859297  0.00000000  1.0
  C  C24  1  0.65461536  0.59666580  0.00000000  1.0
  C  C25  1  0.59851930  0.34724453  0.00000000  1.0
  C  C26  1  0.88291611  0.61708389  0.50000000  1.0
  C  C27  1  0.84724453  0.09851930  0.00000000  1.0
  C  C28  1  0.38215406  0.88215406  0.50000000  1.0
  C  C29  1  0.15140703  0.65140703  0.00000000  1.0
  C  C30  1  0.09666580  0.15461536  0.00000000  1.0
  C  C31  1  0.40148070  0.65275547  0.00000000  1.0