# generated using pymatgen
data_FeP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.59118109
_cell_length_b   6.67588913
_cell_length_c   45.13263097
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   77.13786306
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP
_chemical_formula_sum   'Fe32 P32'
_cell_volume   1936.09593714
_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  0.073654  0.373175  0.283234  1
  Fe  Fe2  1  0.887076  0.634982  0.331425  1
  Fe  Fe3  1  0.483943  0.803144  0.309593  1
  Fe  Fe4  1  0.490525  0.219057  0.305398  1
  Fe  Fe5  1  0.892414  0.204320  0.334020  1
  Fe  Fe6  1  0.707149  0.462653  0.384899  1
  Fe  Fe7  1  0.282642  0.627490  0.362300  1
  Fe  Fe8  1  0.311615  0.045750  0.358678  1
  Fe  Fe9  1  0.706889  0.027535  0.391588  1
  Fe  Fe10  1  0.523286  0.282960  0.440800  1
  Fe  Fe11  1  0.099680  0.439800  0.417613  1
  Fe  Fe12  1  0.131493  0.869926  0.413772  1
  Fe  Fe13  1  0.524155  0.848241  0.446384  1
  Fe  Fe14  1  0.339049  0.103331  0.496228  1
  Fe  Fe15  1  0.915720  0.261635  0.473161  1
  Fe  Fe16  1  0.947288  0.689575  0.469550  1
  Fe  Fe17  1  0.339455  0.668365  0.502014  1
  Fe  Fe18  1  0.154349  0.923455  0.551858  1
  Fe  Fe19  1  0.731216  0.082122  0.528692  1
  Fe  Fe20  1  0.762784  0.510062  0.525081  1
  Fe  Fe21  1  0.155218  0.488737  0.557442  1
  Fe  Fe22  1  0.971615  0.744162  0.606654  1
  Fe  Fe23  1  0.547011  0.901770  0.584470  1
  Fe  Fe24  1  0.578824  0.331896  0.580628  1
  Fe  Fe25  1  0.971355  0.309043  0.613343  1
  Fe  Fe26  1  0.786090  0.567377  0.664222  1
  Fe  Fe27  1  0.366889  0.725946  0.639563  1
  Fe  Fe28  1  0.395862  0.144207  0.635941  1
  Fe  Fe29  1  0.791428  0.136714  0.666816  1
  Fe  Fe30  1  0.604850  0.398521  0.715008  1
  Fe  Fe31  1  0.187979  0.552639  0.692844  1
  Fe  Fe32  1  0.194561  0.968553  0.688649  1
  P  P33  1  0.146133  0.862271  0.322751  1
  P  P34  1  0.818176  0.183450  0.278606  1
  P  P35  1  0.177315  0.360338  0.329216  1
  P  P36  1  0.810562  0.683975  0.278481  1
  P  P37  1  0.959965  0.684424  0.382500  1
  P  P38  1  0.653778  0.985284  0.338667  1
  P  P39  1  0.987607  0.176795  0.384133  1
  P  P40  1  0.607538  0.490884  0.334462  1
  P  P41  1  0.773500  0.505177  0.438135  1
  P  P42  1  0.459188  0.805027  0.393494  1
  P  P43  1  0.803921  0.998676  0.440299  1
  P  P44  1  0.429467  0.312229  0.391193  1
  P  P45  1  0.588635  0.325716  0.493803  1
  P  P46  1  0.274427  0.625574  0.448852  1
  P  P47  1  0.618267  0.819125  0.495784  1
  P  P48  1  0.243949  0.132071  0.446775  1
  P  P49  1  0.404077  0.146122  0.549390  1
  P  P50  1  0.089869  0.445980  0.504438  1
  P  P51  1  0.434555  0.639625  0.551466  1
  P  P52  1  0.060236  0.952572  0.502458  1
  P  P53  1  0.219315  0.966670  0.604748  1
  P  P54  1  0.905004  0.266519  0.560107  1
  P  P55  1  0.249037  0.459468  0.607048  1
  P  P56  1  0.874583  0.773021  0.557943  1
  P  P57  1  0.024726  0.786412  0.659575  1
  P  P58  1  0.718539  0.087273  0.615742  1
  P  P59  1  0.070966  0.280812  0.663779  1
  P  P60  1  0.690897  0.594901  0.614108  1
  P  P61  1  0.860328  0.588246  0.719635  1
  P  P62  1  0.532371  0.909425  0.675491  1
  P  P63  1  0.867942  0.087721  0.719761  1
  P  P64  1  0.501189  0.411358  0.669026  1
