# generated using pymatgen
data_Nd(CrB3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.53266265
_cell_length_b   5.53266265
_cell_length_c   5.53266265
_cell_angle_alpha   147.39413511
_cell_angle_beta   107.19355415
_cell_angle_gamma   82.06799469
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd(CrB3)2
_chemical_formula_sum   'Nd1 Cr2 B6'
_cell_volume   85.12942192
_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  0.50000000  0.00000000  0.50000000  1.0
  Cr  Cr1  1  0.84618000  0.84618000  0.00000000  1.0
  Cr  Cr2  1  0.15382000  0.15382000  0.00000000  1.0
  B  B3  1  0.13936600  0.50000000  0.63936600  1.0
  B  B4  1  0.86063400  0.50000000  0.36063400  1.0
  B  B5  1  0.43308200  0.69753400  0.73554800  1.0
  B  B6  1  0.03801300  0.30246600  0.73554800  1.0
  B  B7  1  0.96198700  0.69753400  0.26445200  1.0
  B  B8  1  0.56691800  0.30246600  0.26445200  1.0