# generated using pymatgen
data_Tm2Ti3Si4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.99228366
_cell_length_b   6.97667416
_cell_length_c   6.78411016
_cell_angle_alpha   89.99955880
_cell_angle_beta   108.84789002
_cell_angle_gamma   89.99957731
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm2Ti3Si4
_chemical_formula_sum   'Tm4 Ti6 Si8'
_cell_volume   313.20286410
_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
  Tm  Tm0  1  0.18979614  0.16950790  0.06721098  1.0
  Tm  Tm1  1  0.81020623  0.66946735  0.43278420  1.0
  Tm  Tm2  1  0.18979204  0.33052478  0.56721590  1.0
  Tm  Tm3  1  0.81020219  0.83050606  0.93279119  1.0
  Ti  Ti4  1  0.50000389  0.49999308  0.00000440  1.0
  Ti  Ti5  1  0.25611338  0.67763967  0.24910148  1.0
  Ti  Ti6  1  0.74388395  0.17767863  0.25085154  1.0
  Ti  Ti7  1  0.50000638  0.00000452  0.50000395  1.0
  Ti  Ti8  1  0.25612000  0.82232405  0.74914731  1.0
  Ti  Ti9  1  0.74388814  0.32235335  0.75089799  1.0
  Si  Si10  1  0.50498388  0.87514250  0.13055809  1.0
  Si  Si11  1  0.91649288  0.46186809  0.13061318  1.0
  Si  Si12  1  0.08348775  0.96186475  0.36937435  1.0
  Si  Si13  1  0.49502480  0.37514456  0.36943780  1.0
  Si  Si14  1  0.50498655  0.62484278  0.63057354  1.0
  Si  Si15  1  0.91650248  0.03813967  0.63061661  1.0
  Si  Si16  1  0.08348712  0.53813201  0.86936917  1.0
  Si  Si17  1  0.49502418  0.12486626  0.86945132  1.0