# generated using pymatgen
data_Nd7PaSe12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.16891673
_cell_length_b   7.88529695
_cell_length_c   16.29613660
_cell_angle_alpha   90.54632898
_cell_angle_beta   89.98798919
_cell_angle_gamma   89.99561334
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd7PaSe12
_chemical_formula_sum   'Nd7 Pa1 Se12'
_cell_volume   535.68091731
_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  0.00035015  0.12065965  0.20692673  1.0
  Nd  Nd1  1  0.00059672  0.62853523  0.29594570  1.0
  Nd  Nd2  1  0.50012555  0.23209965  0.45566198  1.0
  Nd  Nd3  1  0.00012797  0.76403599  0.54380625  1.0
  Nd  Nd4  1  0.50002103  0.36642497  0.70364107  1.0
  Nd  Nd5  1  0.49939991  0.87172069  0.79311237  1.0
  Nd  Nd6  1  0.00003721  0.26670463  0.95875612  1.0
  Pa  Pa7  1  0.50083853  0.74153352  0.03973413  1.0
  Se  Se8  1  0.50003660  0.12425306  0.06979229  1.0
  Se  Se9  1  0.99900597  0.52133096  0.10445335  1.0
  Se  Se10  1  0.50051507  0.83904481  0.21689851  1.0
  Se  Se11  1  0.50036829  0.34371484  0.27904108  1.0
  Se  Se12  1  0.00017536  0.00158749  0.39132746  1.0
  Se  Se13  1  0.50029659  0.61951789  0.43196272  1.0
  Se  Se14  1  0.00004248  0.37627980  0.56769779  1.0
  Se  Se15  1  0.50006956  0.99373148  0.60919250  1.0
  Se  Se16  1  0.99988317  0.65247080  0.72012457  1.0
  Se  Se17  1  0.99990301  0.15768983  0.78278229  1.0
  Se  Se18  1  0.49994225  0.49996976  0.89690721  1.0
  Se  Se19  1  0.99825460  0.87867895  0.93223488  1.0