# generated using pymatgen
data_TiNbReB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98834954
_cell_length_b   5.99452869
_cell_length_c   3.24589721
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiNbReB2
_chemical_formula_sum   'Ti2 Nb2 Re2 B4'
_cell_volume   116.51905351
_cell_formula_units_Z   2
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
  Ti  Ti0  1  0.17791282  0.32079814  0.50000000  1.0
  Ti  Ti1  1  0.67791282  0.17920186  0.50000000  1.0
  Nb  Nb2  1  0.82236492  0.67628875  0.50000000  1.0
  Nb  Nb3  1  0.32236492  0.82371125  0.50000000  1.0
  Re  Re4  1  0.49844725  0.49393221  0.00000000  1.0
  Re  Re5  1  0.99844725  0.00606779  0.00000000  1.0
  B  B6  1  0.11138135  0.60487731  0.00000000  1.0
  B  B7  1  0.61138135  0.89512269  0.00000000  1.0
  B  B8  1  0.38989466  0.11501359  0.00000000  1.0
  B  B9  1  0.88989466  0.38498641  0.00000000  1.0