# generated using pymatgen
data_Nd2Ni5B4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07558538
_cell_length_b   5.49561369
_cell_length_c   6.11221322
_cell_angle_alpha   70.79440544
_cell_angle_beta   65.46806109
_cell_angle_gamma   62.49764247
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Ni5B4
_chemical_formula_sum   'Nd2 Ni5 B4'
_cell_volume   135.56898687
_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  0.72572073  0.19764132  0.35091623  1.0
  Nd  Nd1  1  0.27427927  0.80235868  0.64908377  1.0
  Ni  Ni2  1  0.32937952  0.71995217  0.12775949  1.0
  Ni  Ni3  1  0.67062048  0.28004783  0.87224051  1.0
  Ni  Ni4  1  0.00000000  0.50000000  0.50000000  1.0
  Ni  Ni5  1  0.82290981  0.71995217  0.12775949  1.0
  Ni  Ni6  1  0.17709019  0.28004783  0.87224051  1.0
  B  B7  1  0.59859624  0.94301042  0.85979709  1.0
  B  B8  1  0.40140376  0.05698958  0.14020291  1.0
  B  B9  1  0.22111924  0.39718321  0.16057830  1.0
  B  B10  1  0.77888076  0.60281679  0.83942170  1.0