# generated using pymatgen
data_Ti24P7Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.96609567
_cell_length_b   9.95679332
_cell_length_c   4.98656014
_cell_angle_alpha   89.92157042
_cell_angle_beta   89.92984888
_cell_angle_gamma   89.99786726
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti24P7Se
_chemical_formula_sum   'Ti24 P7 Se1'
_cell_volume   494.81729710
_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
  Ti  Ti0  1  0.97160714  0.85947905  0.28182006  1.0
  Ti  Ti1  1  0.35926805  0.53324012  0.78212139  1.0
  Ti  Ti2  1  0.64316530  0.47614930  0.78399966  1.0
  Ti  Ti3  1  0.02800969  0.13953464  0.28172686  1.0
  Ti  Ti4  1  0.52869085  0.63993790  0.21952891  1.0
  Ti  Ti5  1  0.13934511  0.97171162  0.71752492  1.0
  Ti  Ti6  1  0.86056114  0.02826554  0.71882227  1.0
  Ti  Ti7  1  0.47240733  0.36384522  0.21681695  1.0
  Ti  Ti8  1  0.81901922  0.28388050  0.01099752  1.0
  Ti  Ti9  1  0.78411910  0.68163668  0.51042398  1.0
  Ti  Ti10  1  0.21256548  0.31960649  0.50812784  1.0
  Ti  Ti11  1  0.18035815  0.71618625  0.01056068  1.0
  Ti  Ti12  1  0.68485480  0.21497732  0.48529302  1.0
  Ti  Ti13  1  0.71635895  0.81871702  0.98949793  1.0
  Ti  Ti14  1  0.28015156  0.17998843  0.99391249  1.0
  Ti  Ti15  1  0.31875827  0.78413522  0.48885805  1.0
  Ti  Ti16  1  0.91634359  0.39299547  0.53694712  1.0
  Ti  Ti17  1  0.89353277  0.58347176  0.03583117  1.0
  Ti  Ti18  1  0.10635484  0.41660782  0.03546566  1.0
  Ti  Ti19  1  0.08327066  0.60659193  0.53686358  1.0
  Ti  Ti20  1  0.58605340  0.10260237  0.97163311  1.0
  Ti  Ti21  1  0.60658119  0.91668550  0.46242989  1.0
  Ti  Ti22  1  0.39160929  0.07914283  0.45563751  1.0
  Ti  Ti23  1  0.41627544  0.89323383  0.96486616  1.0
  P  P24  1  0.79501741  0.03965329  0.21406179  1.0
  P  P25  1  0.20509700  0.95728510  0.21175647  1.0
  P  P26  1  0.54133451  0.70776906  0.71405188  1.0
  P  P27  1  0.04050300  0.20630240  0.78668467  1.0
  P  P28  1  0.70722199  0.45936040  0.28729254  1.0
  P  P29  1  0.29289197  0.54161874  0.28664279  1.0
  P  P30  1  0.95870530  0.79331707  0.78647507  1.0
  Se  Se31  1  0.45996851  0.29207214  0.71332706  1.0