# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.76239423
_cell_length_b   22.61472278
_cell_length_c   52.74806273
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP4
_chemical_formula_sum   'Fe36 P144'
_cell_volume   8066.74387328
_cell_formula_units_Z   36
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  0.750916  0.438832  0.395942  1
  Fe  Fe2  1  0.750916  0.709810  0.340098  1
  Fe  Fe3  1  0.750916  0.981741  0.286406  1
  Fe  Fe4  1  0.250916  0.528216  0.324118  1
  Fe  Fe5  1  0.250916  0.800127  0.270683  1
  Fe  Fe6  1  0.250916  0.255004  0.380919  1
  Fe  Fe7  1  0.750916  0.481741  0.286406  1
  Fe  Fe8  1  0.750916  0.938832  0.395942  1
  Fe  Fe9  1  0.750916  0.209810  0.340098  1
  Fe  Fe10  1  0.250916  0.300127  0.270683  1
  Fe  Fe11  1  0.250916  0.755004  0.380919  1
  Fe  Fe12  1  0.250916  0.028216  0.324118  1
  Fe  Fe13  1  0.750916  0.623582  0.562756  1
  Fe  Fe14  1  0.750916  0.895620  0.506930  1
  Fe  Fe15  1  0.750916  0.166969  0.451437  1
  Fe  Fe16  1  0.250916  0.711978  0.491928  1
  Fe  Fe17  1  0.250916  0.984017  0.436102  1
  Fe  Fe18  1  0.250916  0.440630  0.547421  1
  Fe  Fe19  1  0.750916  0.666969  0.451437  1
  Fe  Fe20  1  0.750916  0.123582  0.562756  1
  Fe  Fe21  1  0.750916  0.395620  0.506930  1
  Fe  Fe22  1  0.250916  0.484017  0.436102  1
  Fe  Fe23  1  0.250916  0.940630  0.547421  1
  Fe  Fe24  1  0.250916  0.211978  0.491928  1
  Fe  Fe25  1  0.750916  0.807471  0.728175  1
  Fe  Fe26  1  0.750916  0.079383  0.674741  1
  Fe  Fe27  1  0.750916  0.352594  0.617939  1
  Fe  Fe28  1  0.250916  0.897788  0.658761  1
  Fe  Fe29  1  0.250916  0.168766  0.602916  1
  Fe  Fe30  1  0.250916  0.625858  0.712452  1
  Fe  Fe31  1  0.750916  0.852594  0.617939  1
  Fe  Fe32  1  0.750916  0.307471  0.728175  1
  Fe  Fe33  1  0.750916  0.579383  0.674741  1
  Fe  Fe34  1  0.250916  0.668766  0.602916  1
  Fe  Fe35  1  0.250916  0.125858  0.712452  1
  Fe  Fe36  1  0.250916  0.397788  0.658761  1
  P  P37  1  0.498042  0.454536  0.263166  1
  P  P38  1  0.488126  0.914548  0.374116  1
  P  P39  1  0.489933  0.186066  0.317744  1
  P  P40  1  0.750916  0.665297  0.376700  1
  P  P41  1  0.750916  0.936263  0.322373  1
  P  P42  1  0.750916  0.212769  0.266016  1
  P  P43  1  0.989663  0.551649  0.346536  1
  P  P44  1  0.987665  0.823054  0.292364  1
  P  P45  1  0.988881  0.279504  0.402799  1
  P  P46  1  0.250916  0.660903  0.372388  1
  P  P47  1  0.250916  0.933244  0.317421  1
  P  P48  1  0.250916  0.206437  0.261166  1
  P  P49  1  0.512169  0.551649  0.346536  1
  P  P50  1  0.514167  0.823054  0.292364  1
  P  P51  1  0.512951  0.279504  0.402799  1
  P  P52  1  0.003789  0.454536  0.263166  1
  P  P53  1  0.013706  0.914548  0.374116  1
  P  P54  1  0.011899  0.186066  0.317744  1
  P  P55  1  0.250916  0.528952  0.399519  1
  P  P56  1  0.250916  0.800095  0.344516  1
  P  P57  1  0.250916  0.071305  0.287140  1
  P  P58  1  0.750916  0.533377  0.403559  1
  P  P59  1  0.750916  0.804023  0.348735  1
  P  P60  1  0.750916  0.077488  0.291136  1
  P  P61  1  0.488126  0.414548  0.374116  1
  P  P62  1  0.489933  0.686066  0.317744  1
  P  P63  1  0.498042  0.954536  0.263166  1
  P  P64  1  0.750916  0.436263  0.322373  1
  P  P65  1  0.750916  0.712769  0.266016  1
  P  P66  1  0.750916  0.165297  0.376700  1
  P  P67  1  0.987665  0.323054  0.292364  1
  P  P68  1  0.988881  0.779504  0.402799  1
  P  P69  1  0.989663  0.051649  0.346536  1
  P  P70  1  0.250916  0.433244  0.317421  1
  P  P71  1  0.250916  0.706437  0.261166  1
  P  P72  1  0.250916  0.160903  0.372388  1
  P  P73  1  0.514167  0.323054  0.292364  1
  P  P74  1  0.512951  0.779504  0.402799  1
  P  P75  1  0.512169  0.051649  0.346536  1
  P  P76  1  0.013706  0.414548  0.374116  1
  P  P77  1  0.011899  0.686066  0.317744  1
  P  P78  1  0.003789  0.954536  0.263166  1
  P  P79  1  0.250916  0.571305  0.287140  1
  P  P80  1  0.250916  0.028952  0.399519  1
  P  P81  1  0.250916  0.300095  0.344516  1
  P  P82  1  0.750916  0.577488  0.291136  1
  P  P83  1  0.750916  0.033377  0.403559  1
  P  P84  1  0.750916  0.304023  0.348735  1
  P  P85  1  0.488761  0.642820  0.429490  1
  P  P86  1  0.488796  0.099560  0.540778  1
  P  P87  1  0.488712  0.371263  0.485058  1
  P  P88  1  0.750916  0.850594  0.543404  1
  P  P89  1  0.750916  0.122108  0.487979  1
  P  P90  1  0.750916  0.393729  0.432390  1
  P  P91  1  0.988712  0.736335  0.513801  1
  P  P92  1  0.988796  0.008039  0.458080  1
  P  P93  1  0.988761  0.464779  0.569368  1
  P  P94  1  0.250916  0.846175  0.539368  1
  P  P95  1  0.250916  0.117569  0.483898  1
  P  P96  1  0.250916  0.389393  0.428392  1
  P  P97  1  0.513120  0.736335  0.513801  1
  P  P98  1  0.513036  0.008039  0.458080  1
  P  P99  1  0.513071  0.464779  0.569368  1
  P  P100  1  0.013071  0.642820  0.429490  1
  P  P101  1  0.013036  0.099560  0.540778  1
  P  P102  1  0.013120  0.371263  0.485058  1
  P  P103  1  0.250916  0.713870  0.566468  1
  P  P104  1  0.250916  0.985490  0.510879  1
  P  P105  1  0.250916  0.257005  0.455454  1
  P  P106  1  0.750916  0.718206  0.570466  1
  P  P107  1  0.750916  0.990030  0.514960  1
  P  P108  1  0.750916  0.261423  0.459490  1
  P  P109  1  0.488796  0.599560  0.540778  1
  P  P110  1  0.488712  0.871263  0.485058  1
  P  P111  1  0.488761  0.142820  0.429490  1
  P  P112  1  0.750916  0.622108  0.487979  1
  P  P113  1  0.750916  0.893729  0.432390  1
  P  P114  1  0.750916  0.350594  0.543404  1
  P  P115  1  0.988796  0.508039  0.458080  1
  P  P116  1  0.988761  0.964779  0.569368  1
  P  P117  1  0.988712  0.236335  0.513801  1
  P  P118  1  0.250916  0.617569  0.483898  1
  P  P119  1  0.250916  0.889393  0.428392  1
  P  P120  1  0.250916  0.346175  0.539368  1
  P  P121  1  0.513036  0.508039  0.458080  1
  P  P122  1  0.513071  0.964779  0.569368  1
  P  P123  1  0.513120  0.236335  0.513801  1
  P  P124  1  0.013036  0.599560  0.540778  1
  P  P125  1  0.013120  0.871263  0.485058  1
  P  P126  1  0.013071  0.142820  0.429490  1
  P  P127  1  0.250916  0.757005  0.455454  1
  P  P128  1  0.250916  0.213870  0.566468  1
  P  P129  1  0.250916  0.485490  0.510879  1
  P  P130  1  0.750916  0.761423  0.459490  1
  P  P131  1  0.750916  0.218206  0.570466  1
  P  P132  1  0.750916  0.490030  0.514960  1
  P  P133  1  0.488881  0.828095  0.596059  1
  P  P134  1  0.487665  0.284545  0.706494  1
  P  P135  1  0.489663  0.555950  0.652322  1
  P  P136  1  0.750916  0.036293  0.711718  1
  P  P137  1  0.750916  0.307504  0.654342  1
  P  P138  1  0.750916  0.578646  0.599339  1
  P  P139  1  0.989933  0.921533  0.681114  1
  P  P140  1  0.988126  0.193050  0.624743  1
  P  P141  1  0.998042  0.653062  0.735692  1
  P  P142  1  0.250916  0.030111  0.707723  1
  P  P143  1  0.250916  0.303576  0.650123  1
  P  P144  1  0.250916  0.574222  0.595300  1
  P  P145  1  0.511899  0.921533  0.681114  1
  P  P146  1  0.513706  0.193050  0.624743  1
  P  P147  1  0.503789  0.653062  0.735692  1
  P  P148  1  0.012951  0.828095  0.596059  1
  P  P149  1  0.014167  0.284545  0.706494  1
  P  P150  1  0.012169  0.555950  0.652322  1
  P  P151  1  0.250916  0.894830  0.732842  1
  P  P152  1  0.250916  0.171336  0.676485  1
  P  P153  1  0.250916  0.442301  0.622159  1
  P  P154  1  0.750916  0.901162  0.737692  1
  P  P155  1  0.750916  0.174354  0.681437  1
  P  P156  1  0.750916  0.446695  0.626470  1
  P  P157  1  0.487665  0.784545  0.706494  1
  P  P158  1  0.489663  0.055950  0.652322  1
  P  P159  1  0.488881  0.328095  0.596059  1
  P  P160  1  0.750916  0.807504  0.654342  1
  P  P161  1  0.750916  0.078646  0.599339  1
  P  P162  1  0.750916  0.536293  0.711718  1
  P  P163  1  0.988126  0.693050  0.624743  1
  P  P164  1  0.998042  0.153062  0.735692  1
  P  P165  1  0.989933  0.421533  0.681114  1
  P  P166  1  0.250916  0.803576  0.650123  1
  P  P167  1  0.250916  0.074222  0.595300  1
  P  P168  1  0.250916  0.530111  0.707723  1
  P  P169  1  0.513706  0.693050  0.624743  1
  P  P170  1  0.503789  0.153062  0.735692  1
  P  P171  1  0.511899  0.421533  0.681114  1
  P  P172  1  0.014167  0.784545  0.706494  1
  P  P173  1  0.012169  0.055950  0.652322  1
  P  P174  1  0.012951  0.328095  0.596059  1
  P  P175  1  0.250916  0.942301  0.622159  1
  P  P176  1  0.250916  0.394830  0.732842  1
  P  P177  1  0.250916  0.671336  0.676485  1
  P  P178  1  0.750916  0.946695  0.626470  1
  P  P179  1  0.750916  0.401162  0.737692  1
  P  P180  1  0.750916  0.674354  0.681437  1
