# generated using pymatgen
data_FeP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.12294339
_cell_length_b   21.12264619
_cell_length_c   53.79164228
_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   'Fe60 P60'
_cell_volume   3548.35644621
_cell_formula_units_Z   60
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  0.252565  0.716313  0.312558  1
  Fe  Fe2  1  0.252565  0.333194  0.340799  1
  Fe  Fe3  1  0.252565  0.103619  0.285145  1
  Fe  Fe4  1  0.752565  0.618363  0.291118  1
  Fe  Fe5  1  0.752565  0.234356  0.318663  1
  Fe  Fe6  1  0.752565  0.849254  0.350413  1
  Fe  Fe7  1  0.752565  0.522011  0.329181  1
  Fe  Fe8  1  0.752565  0.138048  0.359528  1
  Fe  Fe9  1  0.752565  0.902471  0.299474  1
  Fe  Fe10  1  0.252565  0.815975  0.275420  1
  Fe  Fe11  1  0.252565  0.434860  0.304686  1
  Fe  Fe12  1  0.252565  0.041670  0.331769  1
  Fe  Fe13  1  0.252565  0.564844  0.403748  1
  Fe  Fe14  1  0.252565  0.181707  0.433229  1
  Fe  Fe15  1  0.252565  0.949096  0.372729  1
  Fe  Fe16  1  0.752565  0.464781  0.380218  1
  Fe  Fe17  1  0.752565  0.082191  0.409775  1
  Fe  Fe18  1  0.752565  0.698040  0.440819  1
  Fe  Fe19  1  0.752565  0.369666  0.420022  1
  Fe  Fe20  1  0.752565  0.987432  0.450376  1
  Fe  Fe21  1  0.752565  0.753881  0.390580  1
  Fe  Fe22  1  0.252565  0.660050  0.363812  1
  Fe  Fe23  1  0.252565  0.276942  0.392783  1
  Fe  Fe24  1  0.252565  0.893622  0.423567  1
  Fe  Fe25  1  0.252565  0.413796  0.494270  1
  Fe  Fe26  1  0.252565  0.031277  0.524464  1
  Fe  Fe27  1  0.252565  0.798450  0.463978  1
  Fe  Fe28  1  0.752565  0.314038  0.470805  1
  Fe  Fe29  1  0.752565  0.931519  0.501000  1
  Fe  Fe30  1  0.752565  0.546865  0.531292  1
  Fe  Fe31  1  0.752565  0.219369  0.511243  1
  Fe  Fe32  1  0.752565  0.836784  0.541317  1
  Fe  Fe33  1  0.752565  0.602864  0.480984  1
  Fe  Fe34  1  0.252565  0.508531  0.453952  1
  Fe  Fe35  1  0.252565  0.125947  0.484027  1
  Fe  Fe36  1  0.252565  0.742451  0.514285  1
  Fe  Fe37  1  0.252565  0.263125  0.585494  1
  Fe  Fe38  1  0.252565  0.880534  0.615051  1
  Fe  Fe39  1  0.252565  0.647275  0.554450  1
  Fe  Fe40  1  0.752565  0.163608  0.562041  1
  Fe  Fe41  1  0.752565  0.780471  0.591522  1
  Fe  Fe42  1  0.752565  0.396219  0.622540  1
  Fe  Fe43  1  0.752565  0.068373  0.602486  1
  Fe  Fe44  1  0.752565  0.685265  0.631458  1
  Fe  Fe45  1  0.752565  0.451694  0.571702  1
  Fe  Fe46  1  0.252565  0.357883  0.544893  1
  Fe  Fe47  1  0.252565  0.975649  0.575247  1
  Fe  Fe48  1  0.252565  0.591434  0.604690  1
  Fe  Fe49  1  0.252565  0.110959  0.676606  1
  Fe  Fe50  1  0.252565  0.726952  0.704151  1
  Fe  Fe51  1  0.252565  0.496061  0.644857  1
  Fe  Fe52  1  0.752565  0.012121  0.654470  1
  Fe  Fe53  1  0.752565  0.629003  0.682712  1
  Fe  Fe54  1  0.752565  0.241696  0.710124  1
  Fe  Fe55  1  0.752565  0.910455  0.690583  1
  Fe  Fe56  1  0.752565  0.529340  0.719849  1
  Fe  Fe57  1  0.752565  0.303646  0.663500  1
  Fe  Fe58  1  0.252565  0.207267  0.635741  1
  Fe  Fe59  1  0.252565  0.823304  0.666089  1
  Fe  Fe60  1  0.252565  0.442845  0.695795  1
  P  P61  1  0.252565  0.452009  0.345627  1
  P  P62  1  0.252565  0.219596  0.282904  1
  P  P63  1  0.252565  0.832574  0.316416  1
  P  P64  1  0.752565  0.728883  0.348245  1
  P  P65  1  0.752565  0.503484  0.284190  1
  P  P66  1  0.752565  0.114037  0.317698  1
  P  P67  1  0.752565  0.724715  0.277849  1
  P  P68  1  0.752565  0.346056  0.307157  1
  P  P69  1  0.752565  0.957345  0.340542  1
  P  P70  1  0.252565  0.608746  0.321603  1
  P  P71  1  0.252565  0.224894  0.350068  1
  P  P72  1  0.252565  0.989806  0.287591  1
  P  P73  1  0.252565  0.300712  0.435738  1
  P  P74  1  0.252565  0.068081  0.374699  1
  P  P75  1  0.252565  0.684330  0.406133  1
  P  P76  1  0.752565  0.578102  0.438533  1
  P  P77  1  0.752565  0.345438  0.376831  1
  P  P78  1  0.752565  0.962963  0.407712  1
  P  P79  1  0.752565  0.573200  0.372320  1
  P  P80  1  0.752565  0.190657  0.401708  1
  P  P81  1  0.752565  0.806986  0.432714  1
  P  P82  1  0.252565  0.455928  0.411450  1
  P  P83  1  0.252565  0.073524  0.441364  1
  P  P84  1  0.252565  0.840557  0.381496  1
  P  P85  1  0.252565  0.150262  0.526902  1
  P  P86  1  0.252565  0.918095  0.466115  1
  P  P87  1  0.252565  0.533267  0.496483  1
  P  P88  1  0.752565  0.427221  0.529154  1
  P  P89  1  0.752565  0.195053  0.468367  1
  P  P90  1  0.752565  0.812048  0.498786  1
  P  P91  1  0.752565  0.422310  0.462813  1
  P  P92  1  0.752565  0.039899  0.492942  1
  P  P93  1  0.752565  0.655854  0.523243  1
  P  P94  1  0.252565  0.305416  0.502328  1
  P  P95  1  0.252565  0.923005  0.532456  1
  P  P96  1  0.252565  0.689461  0.472026  1
  P  P97  1  0.252565  0.999877  0.618439  1
  P  P98  1  0.252565  0.767213  0.556737  1
  P  P99  1  0.252565  0.382352  0.587557  1
  P  P100  1  0.752565  0.277234  0.620571  1
  P  P101  1  0.752565  0.044603  0.559532  1
  P  P102  1  0.752565  0.660985  0.589137  1
  P  P103  1  0.752565  0.271791  0.553906  1
  P  P104  1  0.752565  0.889388  0.583819  1
  P  P105  1  0.752565  0.504758  0.613773  1
  P  P106  1  0.252565  0.154658  0.593561  1
  P  P107  1  0.252565  0.772115  0.622949  1
  P  P108  1  0.252565  0.538329  0.562556  1
  P  P109  1  0.252565  0.841831  0.711080  1
  P  P110  1  0.252565  0.616432  0.647024  1
  P  P111  1  0.252565  0.231278  0.677571  1
  P  P112  1  0.752565  0.125719  0.712366  1
  P  P113  1  0.752565  0.893306  0.649643  1
  P  P114  1  0.752565  0.512742  0.678853  1
  P  P115  1  0.752565  0.120421  0.645202  1
  P  P116  1  0.752565  0.736569  0.673667  1
  P  P117  1  0.752565  0.355510  0.707678  1
  P  P118  1  0.252565  0.999260  0.688113  1
  P  P119  1  0.252565  0.620600  0.717420  1
  P  P120  1  0.252565  0.387970  0.654728  1
