# generated using pymatgen
data_Nd3Th5(ReC2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39081779
_cell_length_b   6.67625449
_cell_length_c   10.08416023
_cell_angle_alpha   89.85703513
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3Th5(ReC2)4
_chemical_formula_sum   'Nd3 Th5 Re4 C8'
_cell_volume   362.93255129
_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  0.75000000  0.69007346  0.54742173  1.0
  Nd  Nd1  1  0.25000000  0.31044508  0.45203422  1.0
  Nd  Nd2  1  0.75000000  0.19179953  0.95175214  1.0
  Th  Th3  1  0.25000000  0.47452357  0.77941978  1.0
  Th  Th4  1  0.75000000  0.02464478  0.28160237  1.0
  Th  Th5  1  0.25000000  0.97630483  0.71836119  1.0
  Th  Th6  1  0.75000000  0.52135446  0.22296878  1.0
  Th  Th7  1  0.25000000  0.81046603  0.04649018  1.0
  Re  Re8  1  0.25000000  0.26945903  0.13853030  1.0
  Re  Re9  1  0.75000000  0.23321468  0.64013970  1.0
  Re  Re10  1  0.25000000  0.76816749  0.36092784  1.0
  Re  Re11  1  0.75000000  0.73279720  0.86025040  1.0
  C  C12  1  0.25000000  0.68368488  0.54772109  1.0
  C  C13  1  0.75000000  0.81965670  0.05072546  1.0
  C  C14  1  0.25000000  0.17407689  0.95148369  1.0
  C  C15  1  0.75000000  0.31707184  0.45230320  1.0
  C  C16  1  0.25000000  0.03240722  0.25742953  1.0
  C  C17  1  0.75000000  0.46955889  0.75812970  1.0
  C  C18  1  0.25000000  0.53183620  0.24126224  1.0
  C  C19  1  0.75000000  0.96845625  0.74104647  1.0