# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.88783642
_cell_length_b   6.16086180
_cell_length_c   48.17711803
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   63.43296394
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe48 P24'
_cell_volume   1828.53205953
_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  0.193912  0.659004  0.316044  1
  Fe  Fe2  1  0.040698  0.259923  0.305778  1
  Fe  Fe3  1  0.777451  0.974734  0.287182  1
  Fe  Fe4  1  0.619150  0.396029  0.310957  1
  Fe  Fe5  1  0.409867  0.890021  0.295817  1
  Fe  Fe6  1  0.810432  0.691334  0.325112  1
  Fe  Fe7  1  0.958717  0.772158  0.372705  1
  Fe  Fe8  1  0.799123  0.390604  0.360736  1
  Fe  Fe9  1  0.472083  0.128262  0.334823  1
  Fe  Fe10  1  0.374580  0.513402  0.365849  1
  Fe  Fe11  1  0.170209  0.016418  0.350773  1
  Fe  Fe12  1  0.566895  0.820666  0.380425  1
  Fe  Fe13  1  0.709657  0.898774  0.427642  1
  Fe  Fe14  1  0.551403  0.510824  0.415916  1
  Fe  Fe15  1  0.227851  0.248730  0.392247  1
  Fe  Fe16  1  0.126765  0.639180  0.421472  1
  Fe  Fe17  1  0.920264  0.136403  0.406376  1
  Fe  Fe18  1  0.319951  0.944039  0.435716  1
  Fe  Fe19  1  0.462598  0.021822  0.483207  1
  Fe  Fe20  1  0.304228  0.635625  0.471464  1
  Fe  Fe21  1  0.980953  0.372140  0.447700  1
  Fe  Fe22  1  0.878953  0.763168  0.477035  1
  Fe  Fe23  1  0.672757  0.259384  0.461783  1
  Fe  Fe24  1  0.072386  0.067923  0.491276  1
  Fe  Fe25  1  0.215016  0.145750  0.538663  1
  Fe  Fe26  1  0.056685  0.759358  0.526975  1
  Fe  Fe27  1  0.733638  0.495805  0.503205  1
  Fe  Fe28  1  0.631319  0.886972  0.532518  1
  Fe  Fe29  1  0.425106  0.383340  0.517323  1
  Fe  Fe30  1  0.825068  0.191276  0.546916  1
  Fe  Fe31  1  0.967556  0.267975  0.594300  1
  Fe  Fe32  1  0.808721  0.884146  0.582481  1
  Fe  Fe33  1  0.486527  0.619438  0.558791  1
  Fe  Fe34  1  0.383436  0.011420  0.587797  1
  Fe  Fe35  1  0.177242  0.507727  0.572802  1
  Fe  Fe36  1  0.579402  0.311855  0.602492  1
  Fe  Fe37  1  0.723478  0.381542  0.650377  1
  Fe  Fe38  1  0.561729  0.013966  0.638491  1
  Fe  Fe39  1  0.236652  0.742328  0.613340  1
  Fe  Fe40  1  0.132114  0.138835  0.643247  1
  Fe  Fe41  1  0.929160  0.634086  0.628115  1
  Fe  Fe42  1  0.335401  0.430696  0.658405  1
  Fe  Fe43  1  0.453681  0.576839  0.701540  1
  Fe  Fe44  1  0.295271  0.092679  0.690460  1
  Fe  Fe45  1  0.017199  0.866263  0.671008  1
  Fe  Fe46  1  0.883070  0.279106  0.698927  1
  Fe  Fe47  1  0.689586  0.750357  0.684764  1
  Fe  Fe48  1  0.092404  0.543234  0.712736  1
  P  P49  1  0.375518  0.288130  0.286677  1
  P  P50  1  0.874031  0.031059  0.329556  1
  P  P51  1  0.759418  0.588418  0.278264  1
  P  P52  1  0.122551  0.410327  0.346583  1
  P  P53  1  0.620123  0.156484  0.383954  1
  P  P54  1  0.493042  0.721370  0.338102  1
  P  P55  1  0.871632  0.531517  0.402672  1
  P  P56  1  0.372883  0.281177  0.439706  1
  P  P57  1  0.245441  0.845131  0.393313  1
  P  P58  1  0.624057  0.655712  0.458205  1
  P  P59  1  0.125351  0.404749  0.495175  1
  P  P60  1  0.998642  0.968578  0.448966  1
  P  P61  1  0.376490  0.779163  0.513740  1
  P  P62  1  0.877850  0.528549  0.550671  1
  P  P63  1  0.750917  0.092792  0.504472  1
  P  P64  1  0.128219  0.904023  0.569315  1
  P  P65  1  0.631439  0.651341  0.606209  1
  P  P66  1  0.503281  0.216818  0.559952  1
  P  P67  1  0.880022  0.025437  0.625966  1
  P  P68  1  0.383007  0.773467  0.659557  1
  P  P69  1  0.255585  0.340974  0.615442  1
  P  P70  1  0.628289  0.143641  0.685540  1
  P  P71  1  0.122306  0.906731  0.720085  1
  P  P72  1  0.005678  0.473516  0.670648  1
