# generated using pymatgen
data_Fe4P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.10156449
_cell_length_b   9.32858925
_cell_length_c   41.61133305
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4P
_chemical_formula_sum   'Fe64 P16'
_cell_volume   2246.93267912
_cell_formula_units_Z   16
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  0.966989  0.702406  0.416671  1
  Fe  Fe2  1  0.564364  0.262487  0.363220  1
  Fe  Fe3  1  0.967522  0.494565  0.366698  1
  Fe  Fe4  1  0.092509  1.003371  0.389936  1
  Fe  Fe5  1  0.380929  0.875071  0.404827  1
  Fe  Fe6  1  0.093516  0.273140  0.375429  1
  Fe  Fe7  1  0.468047  0.477326  0.377496  1
  Fe  Fe8  1  0.710273  0.083284  0.388662  1
  Fe  Fe9  1  0.321221  0.710049  0.452561  1
  Fe  Fe10  1  0.013436  0.173511  0.429495  1
  Fe  Fe11  1  0.199156  0.452382  0.424391  1
  Fe  Fe12  1  0.761800  0.872163  0.438018  1
  Fe  Fe13  1  0.574283  0.529365  0.451258  1
  Fe  Fe14  1  0.410494  0.245238  0.420542  1
  Fe  Fe15  1  0.795867  0.364659  0.412513  1
  Fe  Fe16  1  0.191530  0.971729  0.446370  1
  Fe  Fe17  1  0.679512  0.482620  0.505990  1
  Fe  Fe18  1  0.609027  0.033153  0.513100  1
  Fe  Fe19  1  0.793037  0.298618  0.472417  1
  Fe  Fe20  1  0.987192  0.757448  0.485533  1
  Fe  Fe21  1  0.201264  0.511595  0.494225  1
  Fe  Fe22  1  0.915759  0.048091  0.480844  1
  Fe  Fe23  1  0.270908  0.278002  0.475816  1
  Fe  Fe24  1  0.591117  0.751760  0.496328  1
  Fe  Fe25  1  0.219914  0.298963  0.584313  1
  Fe  Fe26  1  0.947890  0.967327  0.537641  1
  Fe  Fe27  1  0.429213  0.148496  0.554809  1
  Fe  Fe28  1  0.370710  0.573919  0.550299  1
  Fe  Fe29  1  0.660036  0.434721  0.570719  1
  Fe  Fe30  1  0.244303  0.845503  0.541542  1
  Fe  Fe31  1  0.908123  0.274877  0.527466  1
  Fe  Fe32  1  0.989992  0.597697  0.542506  1
  Fe  Fe33  1  0.542297  0.245966  0.618433  1
  Fe  Fe34  1  0.320672  0.749818  0.592594  1
  Fe  Fe35  1  0.642039  0.993972  0.586051  1
  Fe  Fe36  1  0.030721  0.497159  0.602735  1
  Fe  Fe37  1  0.981771  0.147347  0.628458  1
  Fe  Fe38  1  0.820378  0.726695  0.582421  1
  Fe  Fe39  1  0.150921  0.987362  0.591287  1
  Fe  Fe40  1  0.453201  0.544970  0.606851  1
  Fe  Fe41  1  -0.004289  0.028358  0.692970  1
  Fe  Fe42  1  0.751251  0.537799  0.640742  1
  Fe  Fe43  1  0.397184  0.939875  0.634839  1
  Fe  Fe44  1  0.295144  0.372617  0.646097  1
  Fe  Fe45  1  0.686049  0.104427  0.668095  1
  Fe  Fe46  1  0.259530  0.638885  0.651611  1
  Fe  Fe47  1  0.734270  0.860829  0.634361  1
  Fe  Fe48  1  0.929397  0.366401  0.664546  1
  Fe  Fe49  1  0.236662  0.842189  0.725667  1
  Fe  Fe50  1  0.167990  0.573186  0.711507  1
  Fe  Fe51  1  0.554500  0.814588  0.687525  1
  Fe  Fe52  1  0.893417  0.252431  0.719162  1
  Fe  Fe53  1  0.853058  0.875733  0.738098  1
  Fe  Fe54  1  0.760254  0.461815  0.708784  1
  Fe  Fe55  1  0.916997  0.735074  0.689044  1
  Fe  Fe56  1  0.304577  0.319010  0.708835  1
  Fe  Fe57  1  0.718373  0.808099  0.790889  1
  Fe  Fe58  1  0.624905  0.363677  0.761004  1
  Fe  Fe59  1  0.930002  0.634784  0.754236  1
  Fe  Fe60  1  0.180886  0.131923  0.753167  1
  Fe  Fe61  1  0.314552  0.679280  0.775852  1
  Fe  Fe62  1  0.141227  0.397233  0.759330  1
  Fe  Fe63  1  0.548210  0.614738  0.739001  1
  Fe  Fe64  1  0.767477  0.107301  0.769711  1
  P  P65  1  0.094114  0.758339  0.366422  1
  P  P66  1  0.211165  0.115146  0.337723  1
  P  P67  1  0.554006  0.678690  0.407168  1
  P  P68  1  0.627409  0.093076  0.443120  1
  P  P69  1  0.946177  0.538259  0.455884  1
  P  P70  1  0.245327  0.017771  0.501788  1
  P  P71  1  0.336474  0.346917  0.530735  1
  P  P72  1  0.594271  0.818807  0.547893  1
  P  P73  1  0.819583  0.249007  0.582253  1
  P  P74  1  0.036194  0.763425  0.630501  1
  P  P75  1  0.322210  0.142172  0.664901  1
  P  P76  1  0.505661  0.555533  0.685003  1
  P  P77  1  0.601726  0.014306  0.719788  1
  P  P78  1  0.954054  0.493774  0.798673  1
  P  P79  1  0.143416  0.882604  0.778755  1
  P  P80  1  0.345021  0.291533  0.799118  1
