# generated using pymatgen
data_FeP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87621519
_cell_length_b   6.60986620
_cell_length_c   49.87733788
_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   'Fe32 P32'
_cell_volume   1937.28548796
_cell_formula_units_Z   32
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  0.721088  0.810618  0.294609  1
  Fe  Fe2  1  0.299257  0.704637  0.320319  1
  Fe  Fe3  1  0.198757  0.331149  0.294447  1
  Fe  Fe4  1  0.792587  0.194616  0.318372  1
  Fe  Fe5  1  0.702966  0.587741  0.344541  1
  Fe  Fe6  1  0.296688  0.487476  0.374114  1
  Fe  Fe7  1  0.219464  0.101103  0.345783  1
  Fe  Fe8  1  0.796740  0.973174  0.373359  1
  Fe  Fe9  1  0.710349  0.360537  0.400913  1
  Fe  Fe10  1  0.294754  0.264328  0.429473  1
  Fe  Fe11  1  0.210894  0.875401  0.402206  1
  Fe  Fe12  1  0.794602  0.748635  0.428699  1
  Fe  Fe13  1  0.710635  0.136220  0.456461  1
  Fe  Fe14  1  0.294803  0.038139  0.485291  1
  Fe  Fe15  1  0.210991  0.651297  0.457330  1
  Fe  Fe16  1  0.794447  0.523576  0.484140  1
  Fe  Fe17  1  0.710646  0.910807  0.511894  1
  Fe  Fe18  1  0.294813  0.812726  0.540725  1
  Fe  Fe19  1  0.211002  0.425370  0.513046  1
  Fe  Fe20  1  0.794458  0.297648  0.539856  1
  Fe  Fe21  1  0.710694  0.684618  0.567713  1
  Fe  Fe22  1  0.295100  0.588409  0.596272  1
  Fe  Fe23  1  0.210847  0.200311  0.568487  1
  Fe  Fe24  1  0.794554  0.073545  0.594980  1
  Fe  Fe25  1  0.708761  0.461470  0.623071  1
  Fe  Fe26  1  0.302483  0.361205  0.652644  1
  Fe  Fe27  1  0.208709  0.975772  0.623826  1
  Fe  Fe28  1  0.785984  0.847843  0.651403  1
  Fe  Fe29  1  0.706192  0.244309  0.676867  1
  Fe  Fe30  1  0.284361  0.138328  0.702577  1
  Fe  Fe31  1  0.212861  0.754330  0.678813  1
  Fe  Fe32  1  0.806692  0.617796  0.702738  1
  P  P33  1  0.079851  0.658610  0.275658  1
  P  P34  1  0.930167  0.891022  0.330692  1
  P  P35  1  0.579099  0.494118  0.298789  1
  P  P36  1  0.416092  0.027736  0.300800  1
  P  P37  1  0.073503  0.421034  0.334018  1
  P  P38  1  0.924055  0.662033  0.386409  1
  P  P39  1  0.579614  0.272494  0.357778  1
  P  P40  1  0.426343  0.806444  0.360810  1
  P  P41  1  0.080087  0.189375  0.388474  1
  P  P42  1  0.925803  0.435707  0.442020  1
  P  P43  1  0.579893  0.049162  0.414212  1
  P  P44  1  0.425705  0.576835  0.416091  1
  P  P45  1  0.079906  0.964720  0.444140  1
  P  P46  1  0.925665  0.210606  0.497602  1
  P  P47  1  0.579680  0.823038  0.469748  1
  P  P48  1  0.425390  0.351621  0.471790  1
  P  P49  1  0.079783  0.738340  0.499584  1
  P  P50  1  0.925543  0.984226  0.553045  1
  P  P51  1  0.580059  0.597325  0.525396  1
  P  P52  1  0.425768  0.125908  0.527438  1
  P  P53  1  0.079646  0.513239  0.555166  1
  P  P54  1  0.925362  0.759570  0.608711  1
  P  P55  1  0.579744  0.372111  0.581094  1
  P  P56  1  0.425556  0.899784  0.582974  1
  P  P57  1  0.081393  0.286913  0.610777  1
  P  P58  1  0.931946  0.527912  0.663168  1
  P  P59  1  0.579106  0.142502  0.636376  1
  P  P60  1  0.425835  0.676451  0.639407  1
  P  P61  1  0.075281  0.057924  0.666494  1
  P  P62  1  0.925597  0.290336  0.721527  1
  P  P63  1  0.589357  0.921210  0.696386  1
  P  P64  1  0.426350  0.454828  0.698396  1
