# generated using pymatgen
data_Nd2Be2(Re5C)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.92811647
_cell_length_b   6.92811694
_cell_length_c   6.90930551
_cell_angle_alpha   82.35345820
_cell_angle_beta   82.35346355
_cell_angle_gamma   83.40057763
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Be2(Re5C)3
_chemical_formula_sum   'Nd2 Be2 Re15 C3'
_cell_volume   324.16709308
_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
  Nd  Nd0  1  0.65302415  0.65302415  0.65119262  1.0
  Nd  Nd1  1  0.34697585  0.34697585  0.34880738  1.0
  Be  Be2  1  0.50000000  0.00000000  0.00000000  1.0
  Be  Be3  1  0.00000000  0.50000000  0.00000000  1.0
  Re  Re4  1  0.00000000  0.00000000  0.50000000  1.0
  Re  Re5  1  0.72168503  0.27831497  0.00000000  1.0
  Re  Re6  1  0.00061769  0.71954988  0.27261208  1.0
  Re  Re7  1  0.28045012  0.99938231  0.72738792  1.0
  Re  Re8  1  0.99938231  0.28045012  0.72738792  1.0
  Re  Re9  1  0.71954988  0.00061769  0.27261208  1.0
  Re  Re10  1  0.27831497  0.72168503  1.00000000  1.0
  Re  Re11  1  0.35390499  0.85486737  0.34317909  1.0
  Re  Re12  1  0.34065910  0.34065910  0.86601321  1.0
  Re  Re13  1  0.85486737  0.35390499  0.34317909  1.0
  Re  Re14  1  0.64609501  0.14513263  0.65682091  1.0
  Re  Re15  1  0.65934090  0.65934090  0.13398679  1.0
  Re  Re16  1  0.14513263  0.64609501  0.65682091  1.0
  Re  Re17  1  0.90059352  0.90059352  0.89925282  1.0
  Re  Re18  1  0.09940648  0.09940648  0.10074718  1.0
  C  C19  1  0.50000000  0.50000000  0.00000000  1.0
  C  C20  1  0.00000000  0.50000000  0.50000000  1.0
  C  C21  1  0.50000000  0.00000000  0.50000000  1.0