# generated using pymatgen
data_NdB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33268877
_cell_length_b   4.33268877
_cell_length_c   4.25393409
_cell_angle_alpha   65.88151185
_cell_angle_beta   65.88151185
_cell_angle_gamma   99.26860233
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdB4
_chemical_formula_sum   'Nd1 B4'
_cell_volume   61.14687444
_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  0.00000000  0.00000000  0.00000000  1.0
  B  B1  1  0.76189300  0.49888900  0.73608800  1.0
  B  B2  1  0.50111100  0.23810700  0.26391200  1.0
  B  B3  1  0.23810700  0.50111100  0.26391200  1.0
  B  B4  1  0.49888900  0.76189300  0.73608800  1.0