# generated using pymatgen
data_FeP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84300815
_cell_length_b   11.27533727
_cell_length_c   54.73190034
_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   3605.84090733
_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  0.708756  0.319111  0.336006  1
  Fe  Fe2  1  0.709231  0.552943  0.308905  1
  Fe  Fe3  1  0.712000  0.773974  0.282869  1
  Fe  Fe4  1  0.295381  0.174727  0.356408  1
  Fe  Fe5  1  0.305214  0.442641  0.322100  1
  Fe  Fe6  1  0.316184  0.667143  0.297362  1
  Fe  Fe7  1  0.207091  0.057551  0.309013  1
  Fe  Fe8  1  0.207445  0.281567  0.282605  1
  Fe  Fe9  1  0.216786  0.825171  0.336890  1
  Fe  Fe10  1  0.804551  0.164361  0.294217  1
  Fe  Fe11  1  0.800121  0.671961  0.355161  1
  Fe  Fe12  1  0.797565  0.942323  0.319969  1
  Fe  Fe13  1  0.712668  0.552247  0.430921  1
  Fe  Fe14  1  0.712647  0.822510  0.396406  1
  Fe  Fe15  1  0.709229  0.049665  0.369304  1
  Fe  Fe16  1  0.297341  0.434242  0.446940  1
  Fe  Fe17  1  0.294774  0.703935  0.412811  1
  Fe  Fe18  1  0.302303  0.939139  0.384232  1
  Fe  Fe19  1  0.208985  0.322049  0.398840  1
  Fe  Fe20  1  0.212928  0.549959  0.371533  1
  Fe  Fe21  1  0.212946  0.058206  0.431770  1
  Fe  Fe22  1  0.798916  0.443272  0.382497  1
  Fe  Fe23  1  0.799217  0.941448  0.444029  1
  Fe  Fe24  1  0.796777  0.176733  0.415334  1
  Fe  Fe25  1  0.714074  0.818002  0.520475  1
  Fe  Fe26  1  0.712408  0.081013  0.488633  1
  Fe  Fe27  1  0.712424  0.317379  0.459665  1
  Fe  Fe28  1  0.298739  0.707873  0.535816  1
  Fe  Fe29  1  0.298755  0.944239  0.506849  1
  Fe  Fe30  1  0.297089  0.207250  0.475007  1
  Fe  Fe31  1  0.213089  0.587871  0.488692  1
  Fe  Fe32  1  0.212615  0.822939  0.460073  1
  Fe  Fe33  1  0.215866  0.318280  0.523117  1
  Fe  Fe34  1  0.795297  0.706972  0.472365  1
  Fe  Fe35  1  0.798548  0.202313  0.535408  1
  Fe  Fe36  1  0.798074  0.437381  0.506789  1
  Fe  Fe37  1  0.708860  0.086113  0.611249  1
  Fe  Fe38  1  0.716389  0.321317  0.582670  1
  Fe  Fe39  1  0.713822  0.591010  0.548542  1
  Fe  Fe40  1  0.301934  0.975587  0.626178  1
  Fe  Fe41  1  0.298516  0.202743  0.599076  1
  Fe  Fe42  1  0.298495  0.473005  0.564561  1
  Fe  Fe43  1  0.214386  0.848519  0.580148  1
  Fe  Fe44  1  0.211946  0.083804  0.551452  1
  Fe  Fe45  1  0.212247  0.581980  0.612985  1
  Fe  Fe46  1  0.798217  0.967046  0.563712  1
  Fe  Fe47  1  0.798235  0.475293  0.623948  1
  Fe  Fe48  1  0.802178  0.703203  0.596641  1
  Fe  Fe49  1  0.694979  0.358109  0.698119  1
  Fe  Fe50  1  0.705949  0.582611  0.673382  1
  Fe  Fe51  1  0.715782  0.850525  0.639073  1
  Fe  Fe52  1  0.299163  0.251278  0.712613  1
  Fe  Fe53  1  0.301932  0.472309  0.686576  1
  Fe  Fe54  1  0.302407  0.706141  0.659475  1
  Fe  Fe55  1  0.213598  0.082929  0.675513  1
  Fe  Fe56  1  0.211042  0.353291  0.640321  1
  Fe  Fe57  1  0.206612  0.860891  0.701264  1
  Fe  Fe58  1  0.794377  0.200081  0.658592  1
  Fe  Fe59  1  0.803718  0.743685  0.712876  1
  Fe  Fe60  1  0.804072  0.967701  0.686469  1
  P  P61  1  0.083364  0.252097  0.320052  1
  P  P62  1  0.084298  0.496079  0.284823  1
  P  P63  1  0.076142  0.001429  0.347990  1
  P  P64  1  0.929247  0.973226  0.278938  1
  P  P65  1  0.935881  0.492228  0.343906  1
  P  P66  1  0.936743  0.737307  0.315154  1
  P  P67  1  0.579459  0.119791  0.329639  1
  P  P68  1  0.590072  0.363922  0.295063  1
  P  P69  1  0.586148  0.866799  0.357225  1
  P  P70  1  0.430956  0.118276  0.270747  1
  P  P71  1  0.427225  0.626243  0.335635  1
  P  P72  1  0.421596  0.874031  0.299872  1
  P  P73  1  0.083545  0.506766  0.409857  1
  P  P74  1  0.086032  0.754893  0.376785  1
  P  P75  1  0.080159  0.257849  0.438354  1
  P  P76  1  0.917120  0.243275  0.375729  1
  P  P77  1  0.924767  0.750218  0.434113  1
  P  P78  1  0.933451  -0.003973  0.405225  1
  P  P79  1  0.582654  0.370941  0.420008  1
  P  P80  1  0.584588  0.621334  0.391570  1
  P  P81  1  0.579211  0.126116  0.451050  1
  P  P82  1  0.430855  0.374202  0.362442  1
  P  P83  1  0.432098  0.883104  0.423540  1
  P  P84  1  0.423951  0.130127  0.394213  1
  P  P85  1  0.078553  0.767531  0.499105  1
  P  P86  1  0.084213  0.014419  0.469771  1
  P  P87  1  0.085244  0.521907  0.528502  1
  P  P88  1  0.925919  0.503345  0.466980  1
  P  P89  1  0.926950  0.010833  0.525710  1
  P  P90  1  0.932610  0.257721  0.496377  1
  P  P91  1  0.584252  0.633371  0.509876  1
  P  P92  1  0.582165  0.883422  0.481056  1
  P  P93  1  0.585723  0.388291  0.542902  1
  P  P94  1  0.425440  0.636961  0.452580  1
  P  P95  1  0.428998  0.141830  0.514426  1
  P  P96  1  0.426911  0.391881  0.485606  1
  P  P97  1  0.077712  0.029225  0.590257  1
  P  P98  1  0.086396  0.275034  0.561368  1
  P  P99  1  0.094043  0.781977  0.619753  1
  P  P100  1  0.931004  0.767403  0.557128  1
  P  P101  1  0.925131  0.270359  0.618696  1
  P  P102  1  0.927618  0.518486  0.585625  1
  P  P103  1  0.587212  0.895125  0.601268  1
  P  P104  1  0.579065  0.142148  0.571941  1
  P  P105  1  0.580308  0.651050  0.633039  1
  P  P106  1  0.431952  0.899136  0.544431  1
  P  P107  1  0.426575  0.403918  0.603911  1
  P  P108  1  0.428509  0.654311  0.575474  1
  P  P109  1  0.074420  0.287945  0.680328  1
  P  P110  1  0.075282  0.533024  0.651576  1
  P  P111  1  0.081916  0.052026  0.716544  1
  P  P112  1  0.935021  0.023823  0.647492  1
  P  P113  1  0.926864  0.529173  0.710659  1
  P  P114  1  0.927799  0.773155  0.675429  1
  P  P115  1  0.589567  0.151221  0.695610  1
  P  P116  1  0.583938  0.399009  0.659847  1
  P  P117  1  0.580207  0.906976  0.724735  1
  P  P118  1  0.425015  0.158453  0.638257  1
  P  P119  1  0.421091  0.661330  0.700418  1
  P  P120  1  0.431703  0.905461  0.665843  1
