# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.16732444
_cell_length_b   6.87664251
_cell_length_c   48.16501904
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.43946023
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe48 P24'
_cell_volume   1829.04610005
_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  0.842974  0.482746  0.326052  1
  Fe  Fe2  1  0.338420  0.204706  0.306614  1
  Fe  Fe3  1  0.696084  0.046319  0.295528  1
  Fe  Fe4  1  0.090793  0.407426  0.284363  1
  Fe  Fe5  1  0.285965  0.809811  0.312104  1
  Fe  Fe6  1  0.564214  0.616825  0.298169  1
  Fe  Fe7  1  0.746977  0.262528  0.383962  1
  Fe  Fe8  1  0.149405  0.937263  0.358424  1
  Fe  Fe9  1  0.621429  0.776416  0.346660  1
  Fe  Fe10  1  0.960133  0.164607  0.338722  1
  Fe  Fe11  1  0.159467  0.568472  0.368837  1
  Fe  Fe12  1  0.456380  0.368070  0.353990  1
  Fe  Fe13  1  0.612066  0.979741  0.436051  1
  Fe  Fe14  1  0.034137  0.690029  0.414596  1
  Fe  Fe15  1  0.491727  0.540462  0.403495  1
  Fe  Fe16  1  0.836620  0.919922  0.394417  1
  Fe  Fe17  1  0.034039  0.317593  0.424090  1
  Fe  Fe18  1  0.334687  0.118951  0.409500  1
  Fe  Fe19  1  0.479388  0.727838  0.491046  1
  Fe  Fe20  1  0.952710  0.457167  0.471545  1
  Fe  Fe21  1  0.337371  0.300889  0.459956  1
  Fe  Fe22  1  0.713155  0.670578  0.450089  1
  Fe  Fe23  1  0.907454  0.067158  0.479512  1
  Fe  Fe24  1  0.212037  0.872203  0.465064  1
  Fe  Fe25  1  0.356055  0.481165  0.546906  1
  Fe  Fe26  1  0.829621  0.210036  0.526885  1
  Fe  Fe27  1  0.215757  0.051775  0.515171  1
  Fe  Fe28  1  0.590915  0.421212  0.505623  1
  Fe  Fe29  1  0.783789  0.819863  0.534995  1
  Fe  Fe30  1  0.088907  0.626628  0.520689  1
  Fe  Fe31  1  0.232289  0.234736  0.602379  1
  Fe  Fe32  1  0.706995  0.962444  0.582351  1
  Fe  Fe33  1  0.092026  0.804182  0.570653  1
  Fe  Fe34  1  0.468005  0.172749  0.561037  1
  Fe  Fe35  1  0.660221  0.572500  0.590560  1
  Fe  Fe36  1  0.965477  0.379577  0.576312  1
  Fe  Fe37  1  0.110142  0.994941  0.659391  1
  Fe  Fe38  1  0.584616  0.715353  0.637944  1
  Fe  Fe39  1  0.967641  0.556780  0.626001  1
  Fe  Fe40  1  0.343573  0.925590  0.616189  1
  Fe  Fe41  1  0.533004  0.324268  0.646002  1
  Fe  Fe42  1  0.843183  0.131771  0.631832  1
  Fe  Fe43  1  0.985024  0.734549  0.710739  1
  Fe  Fe44  1  0.467481  0.468253  0.692563  1
  Fe  Fe45  1  0.841067  0.310731  0.681798  1
  Fe  Fe46  1  0.228673  0.683206  0.672039  1
  Fe  Fe47  1  0.418227  0.081382  0.700802  1
  Fe  Fe48  1  0.714905  0.886690  0.686681  1
  P  P49  1  0.697459  0.377742  0.276966  1
  P  P50  1  0.954342  0.871601  0.311549  1
  P  P51  1  0.247646  0.493942  0.326455  1
  P  P52  1  0.569629  0.116705  0.337390  1
  P  P53  1  0.819127  0.618687  0.371292  1
  P  P54  1  0.131817  0.244404  0.381704  1
  P  P55  1  0.439745  0.866992  0.390232  1
  P  P56  1  0.689761  0.365920  0.428932  1
  P  P57  1  0.010582  0.995358  0.437172  1
  P  P58  1  0.315794  0.620346  0.445422  1
  P  P59  1  0.569448  0.120205  0.483520  1
  P  P60  1  0.883141  0.745709  0.492633  1
  P  P61  1  0.195708  0.372153  0.501877  1
  P  P62  1  0.446868  0.872786  0.538847  1
  P  P63  1  0.759181  0.498114  0.548154  1
  P  P64  1  0.071811  0.123960  0.557420  1
  P  P65  1  0.324129  0.625728  0.594468  1
  P  P66  1  0.635712  0.250770  0.603674  1
  P  P67  1  0.949810  0.877132  0.613283  1
  P  P68  1  0.197139  0.378670  0.650287  1
  P  P69  1  0.509854  1.001081  0.658609  1
  P  P70  1  0.825869  0.624807  0.668844  1
  P  P71  1  0.067178  0.133680  0.708332  1
  P  P72  1  0.378534  0.732946  0.718549  1
