# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.74382558
_cell_length_b   13.49306699
_cell_length_c   56.89801381
_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   'Fe24 P96'
_cell_volume   5177.42852644
_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  0.429189  0.375423  0.308449  1
  Fe  Fe2  1  0.921211  0.129621  0.392046  1
  Fe  Fe3  1  0.195248  0.254544  0.276079  1
  Fe  Fe4  1  0.695209  0.243579  0.354573  1
  Fe  Fe5  1  0.929189  0.875423  0.308449  1
  Fe  Fe6  1  0.421211  0.629621  0.392046  1
  Fe  Fe7  1  0.695248  0.754544  0.276079  1
  Fe  Fe8  1  0.195209  0.743579  0.354573  1
  Fe  Fe9  1  0.412298  0.373496  0.475689  1
  Fe  Fe10  1  0.904710  0.129262  0.559268  1
  Fe  Fe11  1  0.189487  0.258909  0.437656  1
  Fe  Fe12  1  0.682005  0.243735  0.521267  1
  Fe  Fe13  1  0.912298  0.873496  0.475689  1
  Fe  Fe14  1  0.404710  0.629262  0.559268  1
  Fe  Fe15  1  0.689487  0.758909  0.437656  1
  Fe  Fe16  1  0.182005  0.743735  0.521267  1
  Fe  Fe17  1  0.397001  0.373788  0.642705  1
  Fe  Fe18  1  0.898752  0.130903  0.721595  1
  Fe  Fe19  1  0.174305  0.258631  0.604762  1
  Fe  Fe20  1  0.664168  0.247083  0.688293  1
  Fe  Fe21  1  0.897001  0.873788  0.642705  1
  Fe  Fe22  1  0.398752  0.630903  0.721595  1
  Fe  Fe23  1  0.674305  0.758631  0.604762  1
  Fe  Fe24  1  0.164168  0.747083  0.688293  1
  P  P25  1  0.947057  0.372907  0.269295  1
  P  P26  1  0.439582  0.125936  0.352972  1
  P  P27  1  0.947066  0.127839  0.269279  1
  P  P28  1  0.935688  0.118531  0.351252  1
  P  P29  1  0.434612  0.132232  0.268739  1
  P  P30  1  0.180952  0.005015  0.394006  1
  P  P31  1  0.187507  0.996972  0.309696  1
  P  P32  1  0.439090  0.376906  0.352578  1
  P  P33  1  0.686975  0.250333  0.310459  1
  P  P34  1  0.686039  1.000668  0.310125  1
  P  P35  1  0.929496  0.374419  0.352227  1
  P  P36  1  0.678979  0.002752  0.394191  1
  P  P37  1  0.179882  0.252529  0.393348  1
  P  P38  1  0.440546  0.377258  0.266385  1
  P  P39  1  0.186497  0.248381  0.314500  1
  P  P40  1  0.679642  0.254081  0.395707  1
  P  P41  1  0.447057  0.872907  0.269295  1
  P  P42  1  0.939582  0.625936  0.352972  1
  P  P43  1  0.447066  0.627839  0.269279  1
  P  P44  1  0.435688  0.618531  0.351252  1
  P  P45  1  0.934612  0.632232  0.268739  1
  P  P46  1  0.680952  0.505015  0.394006  1
  P  P47  1  0.687507  0.496972  0.309696  1
  P  P48  1  0.939090  0.876906  0.352578  1
  P  P49  1  0.186975  0.750333  0.310459  1
  P  P50  1  0.186039  0.500668  0.310125  1
  P  P51  1  0.429496  0.874419  0.352227  1
  P  P52  1  0.178979  0.502752  0.394191  1
  P  P53  1  0.679882  0.752529  0.393348  1
  P  P54  1  0.940546  0.877258  0.266385  1
  P  P55  1  0.686497  0.748381  0.314500  1
  P  P56  1  0.179642  0.754081  0.395707  1
  P  P57  1  0.931596  0.375099  0.436303  1
  P  P58  1  0.423946  0.127434  0.519763  1
  P  P59  1  0.930966  0.126814  0.435998  1
  P  P60  1  0.922181  0.119794  0.518175  1
  P  P61  1  0.423854  0.129626  0.435612  1
  P  P62  1  0.165700  0.005051  0.560797  1
  P  P63  1  0.173360  0.997802  0.477276  1
  P  P64  1  0.423346  0.376067  0.519524  1
  P  P65  1  0.671997  0.250316  0.477056  1
  P  P66  1  0.671122  0.999799  0.477445  1
  P  P67  1  0.916394  0.373256  0.519103  1
  P  P68  1  0.663554  0.002998  0.560964  1
  P  P69  1  0.164467  0.252263  0.560517  1
  P  P70  1  0.429794  0.382721  0.434724  1
  P  P71  1  0.172053  0.248625  0.479133  1
  P  P72  1  0.664449  0.253962  0.562605  1
  P  P73  1  0.431596  0.875099  0.436303  1
  P  P74  1  0.923946  0.627434  0.519763  1
  P  P75  1  0.430966  0.626814  0.435998  1
  P  P76  1  0.422181  0.619794  0.518175  1
  P  P77  1  0.923854  0.629626  0.435612  1
  P  P78  1  0.665700  0.505051  0.560797  1
  P  P79  1  0.673360  0.497802  0.477276  1
  P  P80  1  0.923346  0.876067  0.519524  1
  P  P81  1  0.171997  0.750316  0.477056  1
  P  P82  1  0.171122  0.499799  0.477445  1
  P  P83  1  0.416394  0.873256  0.519103  1
  P  P84  1  0.163554  0.502998  0.560964  1
  P  P85  1  0.664467  0.752263  0.560517  1
  P  P86  1  0.929794  0.882721  0.434724  1
  P  P87  1  0.672053  0.748625  0.479133  1
  P  P88  1  0.164449  0.753962  0.562605  1
  P  P89  1  0.916319  0.374950  0.603097  1
  P  P90  1  0.408586  0.127810  0.686756  1
  P  P91  1  0.915720  0.126654  0.603162  1
  P  P92  1  0.907252  0.119601  0.683216  1
  P  P93  1  0.408884  0.129634  0.602582  1
  P  P94  1  0.147830  0.004303  0.728180  1
  P  P95  1  0.159387  0.997019  0.644139  1
  P  P96  1  0.407008  0.375859  0.686765  1
  P  P97  1  0.656657  0.251105  0.644071  1
  P  P98  1  0.654421  0.999291  0.644265  1
  P  P99  1  0.901504  0.375411  0.686380  1
  P  P100  1  0.657165  0.007497  0.728354  1
  P  P101  1  0.146400  0.249729  0.727196  1
  P  P102  1  0.414482  0.382850  0.601590  1
  P  P103  1  0.157699  0.249663  0.646144  1
  P  P104  1  0.652188  0.253361  0.730474  1
  P  P105  1  0.416319  0.874950  0.603097  1
  P  P106  1  0.908586  0.627810  0.686756  1
  P  P107  1  0.415720  0.626654  0.603162  1
  P  P108  1  0.407252  0.619601  0.683216  1
  P  P109  1  0.908884  0.629634  0.602582  1
  P  P110  1  0.647830  0.504303  0.728180  1
  P  P111  1  0.659387  0.497019  0.644139  1
  P  P112  1  0.907008  0.875859  0.686765  1
  P  P113  1  0.156657  0.751105  0.644071  1
  P  P114  1  0.154421  0.499291  0.644265  1
  P  P115  1  0.401504  0.875411  0.686380  1
  P  P116  1  0.157165  0.507497  0.728354  1
  P  P117  1  0.646400  0.749729  0.727196  1
  P  P118  1  0.914482  0.882850  0.601590  1
  P  P119  1  0.657699  0.749663  0.646144  1
  P  P120  1  0.152188  0.753361  0.730474  1
