# generated using pymatgen
data_FeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.51082796
_cell_length_b   8.24798924
_cell_length_c   48.48241236
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   117.35137851
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP2
_chemical_formula_sum   'Fe24 P48'
_cell_volume   3022.85713707
_cell_formula_units_Z   24
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
  Fe  Fe1  1  0.856335  0.484019  0.325111  1
  Fe  Fe2  1  0.192561  0.660862  0.294370  1
  Fe  Fe3  1  0.674073  0.900440  0.341279  1
  Fe  Fe4  1  0.025123  0.057441  0.312795  1
  Fe  Fe5  1  0.118324  0.126877  0.397393  1
  Fe  Fe6  1  0.525913  0.321508  0.356923  1
  Fe  Fe7  1  0.943452  0.544660  0.415294  1
  Fe  Fe8  1  0.339175  0.734459  0.375506  1
  Fe  Fe9  1  0.429222  0.797959  0.467057  1
  Fe  Fe10  1  0.782199  0.966165  0.431282  1
  Fe  Fe11  1  0.270107  0.220901  0.482789  1
  Fe  Fe12  1  0.606361  0.382425  0.449005  1
  Fe  Fe13  1  0.688191  0.442180  0.541143  1
  Fe  Fe14  1  0.092403  0.637163  0.501043  1
  Fe  Fe15  1  0.552105  0.878755  0.556043  1
  Fe  Fe16  1  0.878473  0.034638  0.522537  1
  Fe  Fe17  1  0.022067  0.124019  0.608406  1
  Fe  Fe18  1  0.355533  0.284074  0.574903  1
  Fe  Fe19  1  0.830586  0.533525  0.628719  1
  Fe  Fe20  1  0.152456  0.685528  0.593823  1
  Fe  Fe21  1  0.294186  0.783103  0.676942  1
  Fe  Fe22  1  0.615832  0.931940  0.648455  1
  Fe  Fe23  1  0.094810  0.193446  0.693133  1
  Fe  Fe24  1  0.444584  0.347250  0.666826  1
  P  P25  1  0.882801  0.781880  0.331703  1
  P  P26  1  0.232551  0.955132  0.293237  1
  P  P27  1  0.835225  0.183248  0.313344  1
  P  P28  1  0.468019  0.011764  0.350144  1
  P  P29  1  0.562922  0.383279  0.308330  1
  P  P30  1  0.205415  0.211022  0.348406  1
  P  P31  1  0.513851  0.759724  0.298959  1
  P  P32  1  0.160000  0.574484  0.337731  1
  P  P33  1  0.174678  0.446564  0.403378  1
  P  P34  1  0.535757  0.613316  0.366612  1
  P  P35  1  0.107697  0.830071  0.387395  1
  P  P36  1  0.747932  0.663591  0.423563  1
  P  P37  1  0.836701  0.040563  0.382875  1
  P  P38  1  0.481436  0.871124  0.418061  1
  P  P39  1  0.805390  0.405498  0.372536  1
  P  P40  1  0.439238  0.237765  0.406817  1
  P  P41  1  0.464047  0.100792  0.474336  1
  P  P42  1  0.815065  0.269196  0.439520  1
  P  P43  1  0.398786  0.496624  0.459092  1
  P  P44  1  0.040252  0.319727  0.495355  1
  P  P45  1  0.126325  0.698894  0.453803  1
  P  P46  1  0.774259  0.527054  0.491206  1
  P  P47  1  0.086468  0.066489  0.444337  1
  P  P48  1  0.730822  0.894456  0.479995  1
  P  P49  1  0.746650  0.754168  0.546626  1
  P  P50  1  0.105602  0.935484  0.510346  1
  P  P51  1  0.677796  0.153833  0.531094  1
  P  P52  1  0.321323  0.973848  0.567086  1
  P  P53  1  0.407376  0.355107  0.525910  1
  P  P54  1  0.055972  0.188462  0.561558  1
  P  P55  1  0.374419  0.725840  0.516023  1
  P  P56  1  0.009010  0.553013  0.550856  1
  P  P57  1  0.030273  0.412223  0.619177  1
  P  P58  1  0.385988  0.593559  0.582515  1
  P  P59  1  0.958273  0.809951  0.602730  1
  P  P60  1  0.601608  0.631040  0.639637  1
  P  P61  1  0.698885  0.013674  0.598809  1
  P  P62  1  0.332020  0.848188  0.632218  1
  P  P63  1  0.653230  0.378584  0.588580  1
  P  P64  1  0.302952  0.214657  0.623743  1
  P  P65  1  0.294257  0.063711  0.692544  1
  P  P66  1  0.668345  0.245751  0.654932  1
  P  P67  1  0.244593  0.474673  0.675398  1
  P  P68  1  0.890833  0.282692  0.711572  1
  P  P69  1  0.974104  0.668704  0.671107  1
  P  P70  1  0.602443  0.481304  0.706128  1
  P  P71  1  0.929376  0.034060  0.657289  1
  P  P72  1  0.572591  0.868485  0.696920  1
