# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.75443948
_cell_length_b   16.72427710
_cell_length_c   55.45477791
_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   6264.3445913
_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  0.751506  0.969975  0.410835  1
  Fe  Fe2  1  0.751506  0.300645  0.340047  1
  Fe  Fe3  1  0.251506  0.050598  0.338315  1
  Fe  Fe4  1  0.251506  0.718075  0.409471  1
  Fe  Fe5  1  0.751506  0.965647  0.304796  1
  Fe  Fe6  1  0.751506  0.635357  0.374825  1
  Fe  Fe7  1  0.251506  0.711749  0.303742  1
  Fe  Fe8  1  0.251506  0.383020  0.374126  1
  Fe  Fe9  1  0.751506  0.308925  0.553769  1
  Fe  Fe10  1  0.751506  0.639478  0.482276  1
  Fe  Fe11  1  0.251506  0.387303  0.481183  1
  Fe  Fe12  1  0.251506  0.056274  0.552612  1
  Fe  Fe13  1  0.751506  0.305087  0.446654  1
  Fe  Fe14  1  0.751506  0.974058  0.518083  1
  Fe  Fe15  1  0.251506  0.052436  0.445497  1
  Fe  Fe16  1  0.251506  0.721882  0.516990  1
  Fe  Fe17  1  0.751506  0.649611  0.695524  1
  Fe  Fe18  1  0.751506  0.978340  0.625140  1
  Fe  Fe19  1  0.251506  0.726004  0.624441  1
  Fe  Fe20  1  0.251506  0.395714  0.694470  1
  Fe  Fe21  1  0.751506  0.643286  0.589795  1
  Fe  Fe22  1  0.751506  0.310763  0.660951  1
  Fe  Fe23  1  0.251506  0.391386  0.588431  1
  Fe  Fe24  1  0.251506  0.060716  0.659219  1
  P  P25  1  0.489079  0.260625  0.427891  1
  P  P26  1  0.490864  0.590945  0.355664  1
  P  P27  1  0.751506  0.261102  0.377276  1
  P  P28  1  0.751506  0.589988  0.304652  1
  P  P29  1  0.988636  0.093414  0.357121  1
  P  P30  1  0.991300  0.421580  0.287829  1
  P  P31  1  0.251506  0.253100  0.373256  1
  P  P32  1  0.251506  0.582432  0.300902  1
  P  P33  1  0.514376  0.093414  0.357121  1
  P  P34  1  0.511712  0.421580  0.287829  1
  P  P35  1  0.013933  0.260625  0.427891  1
  P  P36  1  0.012148  0.590945  0.355664  1
  P  P37  1  0.251506  0.092513  0.408134  1
  P  P38  1  0.251506  0.422942  0.336881  1
  P  P39  1  0.751506  0.100134  0.411657  1
  P  P40  1  0.751506  0.431114  0.339816  1
  P  P41  1  0.488489  0.926238  0.391906  1
  P  P42  1  0.493271  0.255518  0.320459  1
  P  P43  1  0.751506  0.926798  0.341775  1
  P  P44  1  0.751506  0.596129  0.412297  1
  P  P45  1  0.987395  0.757970  0.321270  1
  P  P46  1  0.989139  0.427908  0.392801  1
  P  P47  1  0.251506  0.920116  0.335971  1
  P  P48  1  0.251506  0.588026  0.408594  1
  P  P49  1  0.515616  0.757970  0.321270  1
  P  P50  1  0.513872  0.427908  0.392801  1
  P  P51  1  0.014523  0.926238  0.391906  1
  P  P52  1  0.009741  0.255518  0.320459  1
  P  P53  1  0.251506  0.084794  0.300278  1
  P  P54  1  0.251506  0.758415  0.372111  1
  P  P55  1  0.751506  0.095136  0.303955  1
  P  P56  1  0.751506  0.765478  0.375835  1
  P  P57  1  0.489673  0.599127  0.570803  1
  P  P58  1  0.489325  0.929672  0.499257  1
  P  P59  1  0.751506  0.599928  0.519710  1
  P  P60  1  0.751506  0.930421  0.448239  1
  P  P61  1  0.989325  0.431689  0.500009  1
  P  P62  1  0.989673  0.762233  0.428463  1
  P  P63  1  0.251506  0.591760  0.516209  1
  P  P64  1  0.251506  0.922319  0.444724  1
  P  P65  1  0.513687  0.431689  0.500009  1
  P  P66  1  0.513339  0.762233  0.428463  1
  P  P67  1  0.013339  0.599127  0.570803  1
  P  P68  1  0.013687  0.929672  0.499257  1
  P  P69  1  0.251506  0.430940  0.551027  1
  P  P70  1  0.251506  0.761433  0.479555  1
  P  P71  1  0.751506  0.439042  0.554542  1
  P  P72  1  0.751506  0.769601  0.483057  1
  P  P73  1  0.489312  0.264503  0.534956  1
  P  P74  1  0.489289  0.595350  0.463373  1
  P  P75  1  0.751506  0.265261  0.484021  1
  P  P76  1  0.751506  0.934147  0.555473  1
  P  P77  1  0.989312  0.096857  0.464310  1
  P  P78  1  0.989289  0.766011  0.535893  1
  P  P79  1  0.251506  0.257133  0.480543  1
  P  P80  1  0.251506  0.926149  0.552004  1
  P  P81  1  0.513700  0.096857  0.464310  1
  P  P82  1  0.513723  0.766011  0.535893  1
  P  P83  1  0.013700  0.264503  0.534956  1
  P  P84  1  0.013723  0.595350  0.463373  1
  P  P85  1  0.251506  0.427214  0.443793  1
  P  P86  1  0.251506  0.096099  0.515245  1
  P  P87  1  0.751506  0.435211  0.447262  1
  P  P88  1  0.751506  0.104227  0.518723  1
  P  P89  1  0.491300  0.939781  0.711437  1
  P  P90  1  0.488636  0.267947  0.642145  1
  P  P91  1  0.751506  0.938419  0.662385  1
  P  P92  1  0.751506  0.268847  0.591132  1
  P  P93  1  0.990864  0.770415  0.643602  1
  P  P94  1  0.989079  0.100736  0.571375  1
  P  P95  1  0.251506  0.930246  0.659450  1
  P  P96  1  0.251506  0.261226  0.587609  1
  P  P97  1  0.512148  0.770415  0.643602  1
  P  P98  1  0.513933  0.100736  0.571375  1
  P  P99  1  0.011712  0.939781  0.711437  1
  P  P100  1  0.014376  0.267947  0.642145  1
  P  P101  1  0.251506  0.771373  0.694614  1
  P  P102  1  0.251506  0.100259  0.621990  1
  P  P103  1  0.751506  0.778928  0.698363  1
  P  P104  1  0.751506  0.108260  0.626010  1
  P  P105  1  0.487395  0.603391  0.677996  1
  P  P106  1  0.489139  0.933453  0.606465  1
  P  P107  1  0.751506  0.602945  0.627155  1
  P  P108  1  0.751506  0.276566  0.698988  1
  P  P109  1  0.988489  0.435123  0.607360  1
  P  P110  1  0.993271  0.105843  0.678807  1
  P  P111  1  0.251506  0.595882  0.623431  1
  P  P112  1  0.251506  0.266224  0.695311  1
  P  P113  1  0.514523  0.435123  0.607360  1
  P  P114  1  0.509741  0.105843  0.678807  1
  P  P115  1  0.015616  0.603391  0.677996  1
  P  P116  1  0.013872  0.933453  0.606465  1
  P  P117  1  0.251506  0.765232  0.586969  1
  P  P118  1  0.251506  0.434562  0.657491  1
  P  P119  1  0.751506  0.773335  0.590672  1
  P  P120  1  0.751506  0.441244  0.663295  1
