# generated using pymatgen
data_Ti2Nb(BOs)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.07567166
_cell_length_b   8.95649955
_cell_length_c   15.45716037
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2Nb(BOs)3
_chemical_formula_sum   'Ti8 Nb4 B12 Os12'
_cell_volume   425.80228987
_cell_formula_units_Z   4
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  0.00000000  0.80194562  0.49488482  1.0
  Ti  Ti1  1  0.00000000  0.19805438  0.50511518  1.0
  Ti  Ti2  1  0.00000000  0.30194562  0.00511518  1.0
  Ti  Ti3  1  0.00000000  0.69805438  0.99488482  1.0
  Ti  Ti4  1  0.00000000  0.51473904  0.59472457  1.0
  Ti  Ti5  1  0.00000000  0.48526096  0.40527543  1.0
  Ti  Ti6  1  0.00000000  0.01473904  0.90527543  1.0
  Ti  Ti7  1  0.00000000  0.98526096  0.09472457  1.0
  Nb  Nb8  1  0.00000000  0.68378691  0.20505611  1.0
  Nb  Nb9  1  0.00000000  0.31621309  0.79494389  1.0
  Nb  Nb10  1  0.00000000  0.18378691  0.29494389  1.0
  Nb  Nb11  1  0.00000000  0.81621309  0.70505611  1.0
  B  B12  1  0.50000000  0.60324513  0.49551346  1.0
  B  B13  1  0.50000000  0.39675487  0.50448654  1.0
  B  B14  1  0.50000000  0.10324513  0.00448654  1.0
  B  B15  1  0.50000000  0.89675487  0.99551346  1.0
  B  B16  1  0.00000000  0.61044187  0.83461072  1.0
  B  B17  1  0.00000000  0.38955813  0.16538928  1.0
  B  B18  1  0.00000000  0.11044187  0.66538928  1.0
  B  B19  1  0.00000000  0.88955813  0.33461072  1.0
  B  B20  1  0.50000000  0.71241853  0.59837974  1.0
  B  B21  1  0.50000000  0.28758147  0.40162026  1.0
  B  B22  1  0.50000000  0.21241853  0.90162026  1.0
  B  B23  1  0.50000000  0.78758147  0.09837974  1.0
  Os  Os24  1  0.50000000  0.71656140  0.36023797  1.0
  Os  Os25  1  0.50000000  0.28343860  0.63976203  1.0
  Os  Os26  1  0.50000000  0.21656140  0.13976203  1.0
  Os  Os27  1  0.50000000  0.78343860  0.86023797  1.0
  Os  Os28  1  0.50000000  0.51974545  0.09307843  1.0
  Os  Os29  1  0.50000000  0.48025455  0.90692157  1.0
  Os  Os30  1  0.50000000  0.01974545  0.40692157  1.0
  Os  Os31  1  0.50000000  0.98025455  0.59307843  1.0
  Os  Os32  1  0.50000000  0.56647294  0.73175526  1.0
  Os  Os33  1  0.50000000  0.43352706  0.26824474  1.0
  Os  Os34  1  0.50000000  0.06647294  0.76824474  1.0
  Os  Os35  1  0.50000000  0.93352706  0.23175526  1.0