# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.69109722
_cell_length_b   6.77245142
_cell_length_c   47.73522869
_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   'Fe12 P48'
_cell_volume   3132.98168928
_cell_formula_units_Z   12
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  0.114470  0.250172  0.307792  1
  Fe  Fe2  1  0.382488  0.750172  0.377581  1
  Fe  Fe3  1  0.620840  0.250172  0.377581  1
  Fe  Fe4  1  0.888859  0.750172  0.307792  1
  Fe  Fe5  1  0.123489  0.250172  0.449757  1
  Fe  Fe6  1  0.380162  0.750172  0.521266  1
  Fe  Fe7  1  0.623166  0.250172  0.521266  1
  Fe  Fe8  1  0.879840  0.750172  0.449757  1
  Fe  Fe9  1  0.122422  0.250172  0.592963  1
  Fe  Fe10  1  0.384299  0.750172  0.663745  1
  Fe  Fe11  1  0.619030  0.250172  0.663745  1
  Fe  Fe12  1  0.880906  0.750172  0.592963  1
  P  P13  1  0.752335  0.512780  0.378303  1
  P  P14  1  0.988864  0.250172  0.413286  1
  P  P15  1  0.250994  0.012780  0.378303  1
  P  P16  1  0.014464  0.750172  0.413286  1
  P  P17  1  0.250994  0.487564  0.378303  1
  P  P18  1  0.752335  0.987564  0.378303  1
  P  P19  1  0.015323  0.750172  0.344958  1
  P  P20  1  0.988006  0.250172  0.344958  1
  P  P21  1  0.249804  0.507541  0.307018  1
  P  P22  1  0.491048  0.250172  0.340275  1
  P  P23  1  0.753524  0.007541  0.307018  1
  P  P24  1  0.512281  0.750172  0.340275  1
  P  P25  1  0.753524  0.492803  0.307018  1
  P  P26  1  0.249804  0.992803  0.307018  1
  P  P27  1  0.512773  0.750172  0.414769  1
  P  P28  1  0.490555  0.250172  0.414769  1
  P  P29  1  0.754741  0.512350  0.521262  1
  P  P30  1  0.989996  0.250172  0.556117  1
  P  P31  1  0.248587  0.012350  0.521262  1
  P  P32  1  0.013333  0.750172  0.556117  1
  P  P33  1  0.248587  0.487994  0.521262  1
  P  P34  1  0.754741  0.987994  0.521262  1
  P  P35  1  0.013758  0.750172  0.486381  1
  P  P36  1  0.989571  0.250172  0.486381  1
  P  P37  1  0.255114  0.512284  0.449711  1
  P  P38  1  0.489660  0.250172  0.484595  1
  P  P39  1  0.748214  0.012284  0.449711  1
  P  P40  1  0.513668  0.750172  0.484595  1
  P  P41  1  0.748214  0.488060  0.449711  1
  P  P42  1  0.255114  0.988060  0.449711  1
  P  P43  1  0.513971  0.750172  0.557886  1
  P  P44  1  0.489357  0.250172  0.557886  1
  P  P45  1  0.754427  0.509347  0.664336  1
  P  P46  1  0.991343  0.250172  0.697783  1
  P  P47  1  0.248901  0.009347  0.664336  1
  P  P48  1  0.011985  0.750172  0.697783  1
  P  P49  1  0.248901  0.490998  0.664336  1
  P  P50  1  0.754427  0.990998  0.664336  1
  P  P51  1  0.012981  0.750172  0.629874  1
  P  P52  1  0.990347  0.250172  0.629874  1
  P  P53  1  0.253766  0.512810  0.592747  1
  P  P54  1  0.487377  0.250172  0.627131  1
  P  P55  1  0.749562  0.012810  0.592747  1
  P  P56  1  0.515952  0.750172  0.627131  1
  P  P57  1  0.749562  0.487534  0.592747  1
  P  P58  1  0.253766  0.987534  0.592747  1
  P  P59  1  0.511498  0.750172  0.701436  1
  P  P60  1  0.491830  0.250172  0.701436  1
