# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.06494737
_cell_length_b   16.26909863
_cell_length_c   48.93158895
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe60 P30'
_cell_volume   2439.92137842
_cell_formula_units_Z   30
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  0.002406  0.922580  0.321666  1
  Fe  Fe2  1  0.002406  0.287365  0.361491  1
  Fe  Fe3  1  0.002406  0.163004  0.305125  1
  Fe  Fe4  1  0.002406  0.531517  0.343004  1
  Fe  Fe5  1  0.002406  0.073417  0.360234  1
  Fe  Fe6  1  0.002406  0.735901  0.320058  1
  Fe  Fe7  1  0.502406  0.050218  0.319267  1
  Fe  Fe8  1  0.502406  0.414163  0.358198  1
  Fe  Fe9  1  0.502406  0.289982  0.313574  1
  Fe  Fe10  1  0.502406  0.656561  0.356406  1
  Fe  Fe11  1  0.502406  0.825411  0.346953  1
  Fe  Fe12  1  0.502406  0.472185  0.304609  1
  Fe  Fe13  1  0.002406  0.638642  0.403081  1
  Fe  Fe14  1  0.002406  1.000814  0.445758  1
  Fe  Fe15  1  0.002406  0.892318  0.383679  1
  Fe  Fe16  1  0.002406  0.251312  0.423489  1
  Fe  Fe17  1  0.002406  0.785654  0.445535  1
  Fe  Fe18  1  0.002406  0.437480  0.400596  1
  Fe  Fe19  1  0.502406  0.770756  0.402513  1
  Fe  Fe20  1  0.502406  0.128157  0.443098  1
  Fe  Fe21  1  0.502406  0.011575  0.400622  1
  Fe  Fe22  1  0.502406  0.369868  0.440371  1
  Fe  Fe23  1  0.502406  0.539225  0.428992  1
  Fe  Fe24  1  0.502406  0.183510  0.388687  1
  Fe  Fe25  1  0.002406  0.357079  0.485970  1
  Fe  Fe26  1  0.002406  0.714091  0.528382  1
  Fe  Fe27  1  0.002406  0.607906  0.465776  1
  Fe  Fe28  1  0.002406  0.966025  0.508559  1
  Fe  Fe29  1  0.002406  0.500272  0.527313  1
  Fe  Fe30  1  0.002406  0.143977  0.486099  1
  Fe  Fe31  1  0.502406  0.484946  0.484415  1
  Fe  Fe32  1  0.502406  0.842865  0.527086  1
  Fe  Fe33  1  0.502406  0.726962  0.483145  1
  Fe  Fe34  1  0.502406  0.083554  0.525231  1
  Fe  Fe35  1  0.502406  0.253348  0.511803  1
  Fe  Fe36  1  0.502406  0.896554  0.471576  1
  Fe  Fe37  1  0.002406  0.072355  0.569611  1
  Fe  Fe38  1  0.002406  0.415499  0.605039  1
  Fe  Fe39  1  0.002406  0.322740  0.550344  1
  Fe  Fe40  1  0.002406  0.679923  0.590712  1
  Fe  Fe41  1  0.002406  0.220004  0.609858  1
  Fe  Fe42  1  0.002406  0.856709  0.570368  1
  Fe  Fe43  1  0.502406  0.194298  0.568312  1
  Fe  Fe44  1  0.502406  0.554448  0.609176  1
  Fe  Fe45  1  0.502406  0.441885  0.564589  1
  Fe  Fe46  1  0.502406  0.797542  0.608437  1
  Fe  Fe47  1  0.502406  0.967788  0.597042  1
  Fe  Fe48  1  0.502406  0.610241  0.553563  1
  Fe  Fe49  1  0.002406  0.780822  0.653695  1
  Fe  Fe50  1  0.002406  0.147049  0.691510  1
  Fe  Fe51  1  0.002406  0.029589  0.641235  1
  Fe  Fe52  1  0.002406  0.398245  0.676568  1
  Fe  Fe53  1  0.002406  0.925726  0.692596  1
  Fe  Fe54  1  0.002406  0.574157  0.654212  1
  Fe  Fe55  1  0.502406  0.908077  0.653215  1
  Fe  Fe56  1  0.502406  0.277226  0.694202  1
  Fe  Fe57  1  0.502406  0.155423  0.649955  1
  Fe  Fe58  1  0.502406  0.516265  0.690285  1
  Fe  Fe59  1  0.502406  0.667390  0.680770  1
  Fe  Fe60  1  0.502406  0.324836  0.635692  1
  P  P61  1  0.502406  0.964046  0.356470  1
  P  P62  1  0.502406  0.614428  0.312080  1
  P  P63  1  0.502406  0.179527  0.343198  1
  P  P64  1  0.502406  0.828039  0.297512  1
  P  P65  1  0.002406  0.023546  0.284974  1
  P  P66  1  0.002406  0.388781  0.325285  1
  P  P67  1  0.502406  0.678474  0.437989  1
  P  P68  1  0.502406  0.325337  0.395782  1
  P  P69  1  0.502406  0.893162  0.425083  1
  P  P70  1  0.502406  0.538922  0.381816  1
  P  P71  1  0.002406  0.748710  0.369972  1
  P  P72  1  1.002406  0.107097  0.410080  1
  P  P73  1  0.502406  0.391638  0.520702  1
  P  P74  1  0.502406  0.036420  0.480205  1
  P  P75  1  0.502406  0.607674  0.506937  1
  P  P76  1  0.502406  0.250776  0.465018  1
  P  P77  1  1.002406  0.464266  0.451260  1
  P  P78  1  1.002406  0.822309  0.494180  1
  P  P79  1  0.502406  0.103021  0.607208  1
  P  P80  1  0.502406  0.749875  0.563091  1
  P  P81  1  0.502406  0.317421  0.588753  1
  P  P82  1  0.502406  0.964168  0.550086  1
  P  P83  1  0.002406  0.180544  0.534799  1
  P  P84  1  0.002406  0.537014  0.576503  1
  P  P85  1  0.502406  0.809850  0.690914  1
  P  P86  1  0.502406  0.460782  0.643411  1
  P  P87  1  0.502406  0.037337  0.679526  1
  P  P88  1  0.502406  0.677522  0.631815  1
  P  P89  1  0.002406  0.893213  0.619218  1
  P  P90  1  0.002406  0.254936  0.658843  1
