# generated using pymatgen
data_Sc5Ta6TiOs12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.49198613
_cell_length_b   6.34907122
_cell_length_c   13.47882963
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00010489
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc5Ta6TiOs12
_chemical_formula_sum   'Sc5 Ta6 Ti1 Os12'
_cell_volume   384.41541042
_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
  Sc  Sc0  1  0.00000310  0.00000000  0.99944753  1.0
  Sc  Sc1  1  0.49999486  0.50000000  0.16582451  1.0
  Sc  Sc2  1  0.99999487  0.00000000  0.33332380  1.0
  Sc  Sc3  1  0.49999682  0.50000000  0.50083274  1.0
  Sc  Sc4  1  0.00000486  0.00000000  0.66723082  1.0
  Ta  Ta5  1  0.00000175  0.50000000  0.99905028  1.0
  Ta  Ta6  1  0.49999408  0.00000000  0.16645421  1.0
  Ta  Ta7  1  0.99999236  0.50000000  0.33332471  1.0
  Ta  Ta8  1  0.49999993  0.00000000  0.50020432  1.0
  Ta  Ta9  1  0.99999789  0.50000000  0.66761885  1.0
  Ta  Ta10  1  0.50000944  0.00000000  0.83334390  1.0
  Ti  Ti11  1  0.50000537  0.50000000  0.83333961  1.0
  Os  Os12  1  0.50000258  0.25267869  0.99688391  1.0
  Os  Os13  1  0.50000258  0.74732131  0.99688391  1.0
  Os  Os14  1  0.99999499  0.24985871  0.16579922  1.0
  Os  Os15  1  0.99999499  0.75014129  0.16579922  1.0
  Os  Os16  1  0.49999454  0.24986658  0.33332688  1.0
  Os  Os17  1  0.49999454  0.75013342  0.33332688  1.0
  Os  Os18  1  0.99999839  0.24985471  0.50085923  1.0
  Os  Os19  1  0.99999839  0.75014529  0.50085923  1.0
  Os  Os20  1  0.50000253  0.25268117  0.66979296  1.0
  Os  Os21  1  0.50000253  0.74731883  0.66979296  1.0
  Os  Os22  1  0.00000681  0.25506648  0.83334017  1.0
  Os  Os23  1  0.00000681  0.74493352  0.83334017  1.0