# generated using pymatgen
data_FeP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78345176
_cell_length_b   5.87845911
_cell_length_c   47.37717097
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP
_chemical_formula_sum   'Fe28 P28'
_cell_volume   1610.71885709
_cell_formula_units_Z   28
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  0.013319  0.295817  0.315269  1
  Fe  Fe2  1  0.997233  0.720719  0.284097  1
  Fe  Fe3  1  0.497233  0.784346  0.284097  1
  Fe  Fe4  1  0.513319  0.209248  0.315269  1
  Fe  Fe5  1  0.012100  0.294192  0.380424  1
  Fe  Fe6  1  0.995128  0.710333  0.346736  1
  Fe  Fe7  1  0.495128  0.794732  0.346736  1
  Fe  Fe8  1  0.512100  0.210873  0.380424  1
  Fe  Fe9  1  0.012791  0.294396  0.446765  1
  Fe  Fe10  1  0.994193  0.710853  0.413821  1
  Fe  Fe11  1  0.494193  0.794212  0.413821  1
  Fe  Fe12  1  0.512791  0.210669  0.446765  1
  Fe  Fe13  1  0.012740  0.294350  0.513687  1
  Fe  Fe14  1  0.994245  0.710714  0.480135  1
  Fe  Fe15  1  0.494245  0.794350  0.480135  1
  Fe  Fe16  1  0.512740  0.210714  0.513687  1
  Fe  Fe17  1  0.012792  0.294212  0.580001  1
  Fe  Fe18  1  0.994194  0.710669  0.547057  1
  Fe  Fe19  1  0.494194  0.794396  0.547057  1
  Fe  Fe20  1  0.512792  0.210853  0.580001  1
  Fe  Fe21  1  0.011857  0.294732  0.647086  1
  Fe  Fe22  1  0.994885  0.710873  0.613398  1
  Fe  Fe23  1  0.494885  0.794192  0.613398  1
  Fe  Fe24  1  0.511857  0.210333  0.647086  1
  Fe  Fe25  1  0.009751  0.284346  0.709725  1
  Fe  Fe26  1  0.993666  0.709248  0.678553  1
  Fe  Fe27  1  0.493666  0.795817  0.678553  1
  Fe  Fe28  1  0.509751  0.220719  0.709725  1
  P  P29  1  0.231508  0.932199  0.312360  1
  P  P30  1  0.768131  0.087079  0.276280  1
  P  P31  1  0.268131  0.417986  0.276280  1
  P  P32  1  0.731508  0.572866  0.312360  1
  P  P33  1  0.235828  0.924285  0.380012  1
  P  P34  1  0.773061  0.077832  0.346826  1
  P  P35  1  0.273061  0.427233  0.346826  1
  P  P36  1  0.735828  0.580780  0.380012  1
  P  P37  1  0.235299  0.926135  0.446890  1
  P  P38  1  0.771502  0.079292  0.413434  1
  P  P39  1  0.271502  0.425773  0.413434  1
  P  P40  1  0.735299  0.578930  0.446890  1
  P  P41  1  0.235684  0.925312  0.513578  1
  P  P42  1  0.771301  0.079753  0.480244  1
  P  P43  1  0.271301  0.425312  0.480244  1
  P  P44  1  0.735684  0.579753  0.513578  1
  P  P45  1  0.235483  0.925773  0.580388  1
  P  P46  1  0.771685  0.078930  0.546932  1
  P  P47  1  0.271685  0.426135  0.546932  1
  P  P48  1  0.735483  0.579292  0.580388  1
  P  P49  1  0.233923  0.927233  0.646996  1
  P  P50  1  0.771156  0.080780  0.613810  1
  P  P51  1  0.271156  0.424285  0.613810  1
  P  P52  1  0.733923  0.577832  0.646996  1
  P  P53  1  0.238853  0.917986  0.717542  1
  P  P54  1  0.775476  0.072866  0.681462  1
  P  P55  1  0.275476  0.432199  0.681462  1
  P  P56  1  0.738853  0.587079  0.717542  1
