# generated using pymatgen
data_Fe5Ni4P3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.39170303
_cell_length_b   6.69287104
_cell_length_c   19.08938442
_cell_angle_alpha   87.86761262
_cell_angle_beta   83.64408248
_cell_angle_gamma   71.04077359
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5Ni4P3
_chemical_formula_sum   'Fe20 Ni16 P12'
_cell_volume   527.39456428
_cell_formula_units_Z   4
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  Fe0  1  0.31506100  0.81598900  0.01064500  1
  Fe  Fe1  1  0.64825800  0.81543700  0.34417500  1
  Fe  Fe2  1  0.98096200  0.81546600  0.67739000  1
  Fe  Fe3  1  0.47725300  0.18551400  0.32329200  1
  Fe  Fe4  1  0.81071900  0.18523800  0.65649400  1
  Fe  Fe5  1  0.14200300  0.18440500  0.98883700  1
  Fe  Fe6  1  0.72394100  0.02871800  0.06132900  1
  Fe  Fe7  1  0.05542700  0.03176800  0.39523800  1
  Fe  Fe8  1  0.38866300  0.03210800  0.72858000  1
  Fe  Fe9  1  0.14922900  0.97141600  0.27187500  1
  Fe  Fe10  1  0.48174200  0.97213600  0.60525100  1
  Fe  Fe11  1  0.81404600  0.97238700  0.93844500  1
  Fe  Fe12  1  0.06342000  0.39457500  0.44346200  1
  Fe  Fe13  1  0.39731900  0.39430600  0.77680400  1
  Fe  Fe14  1  0.12156000  0.67102300  0.13240200  1
  Fe  Fe15  1  0.45421100  0.67005700  0.46518900  1
  Fe  Fe16  1  0.78700900  0.67007100  0.79856900  1
  Fe  Fe17  1  0.25759600  0.32889000  0.20101600  1
  Fe  Fe18  1  0.58902900  0.32855500  0.53465400  1
  Fe  Fe19  1  0.92339900  0.32849800  0.86794100  1
  Ni  Ni20  1  0.93336900  0.61207300  0.01693500  1
  Ni  Ni21  1  0.26674800  0.61153700  0.34937400  1
  Ni  Ni22  1  0.59982000  0.61174900  0.68264900  1
  Ni  Ni23  1  0.89803000  0.38921800  0.31631200  1
  Ni  Ni24  1  0.23050600  0.38907300  0.64978500  1
  Ni  Ni25  1  0.56252300  0.38718700  0.98306300  1
  Ni  Ni26  1  0.16222800  0.05158800  0.12936600  1
  Ni  Ni27  1  0.49719600  0.04773000  0.46310100  1
  Ni  Ni28  1  0.83082400  0.04785800  0.79637300  1
  Ni  Ni29  1  0.67532600  0.94832600  0.20396900  1
  Ni  Ni30  1  0.00798900  0.94821400  0.53736100  1
  Ni  Ni31  1  0.34167100  0.94828000  0.87084800  1
  Ni  Ni32  1  0.56461300  0.60398400  0.22298100  1
  Ni  Ni33  1  0.89503000  0.60458900  0.55681000  1
  Ni  Ni34  1  0.22786500  0.60514000  0.89020400  1
  Ni  Ni35  1  0.72569500  0.39556100  0.11051100  1
  P  P36  1  0.02682100  0.65922700  0.25247000  1
  P  P37  1  0.35890700  0.65985700  0.58563500  1
  P  P38  1  0.69341100  0.65837000  0.91938500  1
  P  P39  1  0.27166800  0.34227700  0.08059000  1
  P  P40  1  0.60693000  0.34316000  0.41472900  1
  P  P41  1  0.94006200  0.34307400  0.74797200  1
  P  P42  1  0.58107200  0.75831200  0.11314000  1
  P  P43  1  0.91662200  0.75553200  0.44623900  1
  P  P44  1  0.24977900  0.75545700  0.77961400  1
  P  P45  1  0.78522900  0.24141000  0.22026200  1
  P  P46  1  0.11755100  0.24211100  0.55277300  1
  P  P47  1  0.45166500  0.24255300  0.88596000  1
