# generated using pymatgen
data_FeNiP2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.31723900
_cell_length_b   7.73982400
_cell_length_c   14.09115500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNiP2O9
_chemical_formula_sum   'Fe4 Ni4 P8 O36'
_cell_volume   688.97741392
_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  0.75000000  0.84564500  0.38096900  1.0
  Fe  Fe1  1  0.25000000  0.15435500  0.61903100  1.0
  Fe  Fe2  1  0.25000000  0.34564500  0.11903100  1.0
  Fe  Fe3  1  0.75000000  0.65435500  0.88096900  1.0
  Ni  Ni4  1  0.50000000  0.50000000  0.50000000  1.0
  Ni  Ni5  1  0.50000000  0.00000000  0.00000000  1.0
  Ni  Ni6  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni7  1  0.00000000  0.50000000  0.50000000  1.0
  P  P8  1  0.25000000  0.84954000  0.43846700  1.0
  P  P9  1  0.75000000  0.15046000  0.56153300  1.0
  P  P10  1  0.75000000  0.34954000  0.06153300  1.0
  P  P11  1  0.25000000  0.65046000  0.93846700  1.0
  P  P12  1  0.75000000  0.89038500  0.18775200  1.0
  P  P13  1  0.25000000  0.10961500  0.81224800  1.0
  P  P14  1  0.25000000  0.39038500  0.31224800  1.0
  P  P15  1  0.75000000  0.60961500  0.68775200  1.0
  O  O16  1  0.04613900  0.09805100  0.87203600  1.0
  O  O17  1  0.54613900  0.90194900  0.12796400  1.0
  O  O18  1  0.95386100  0.59805100  0.62796400  1.0
  O  O19  1  0.45386100  0.40194900  0.37203600  1.0
  O  O20  1  0.95386100  0.90194900  0.12796400  1.0
  O  O21  1  0.45386100  0.09805100  0.87203600  1.0
  O  O22  1  0.04613900  0.40194900  0.37203600  1.0
  O  O23  1  0.54613900  0.59805100  0.62796400  1.0
  O  O24  1  0.25000000  0.83846900  0.97976700  1.0
  O  O25  1  0.75000000  0.16153100  0.02023300  1.0
  O  O26  1  0.75000000  0.33846900  0.52023300  1.0
  O  O27  1  0.25000000  0.66153100  0.47976700  1.0
  O  O28  1  0.75000000  0.64076000  0.45354400  1.0
  O  O29  1  0.25000000  0.35924000  0.54645600  1.0
  O  O30  1  0.25000000  0.14076000  0.04645600  1.0
  O  O31  1  0.75000000  0.85924000  0.95354400  1.0
  O  O32  1  0.75000000  0.72298300  0.24863900  1.0
  O  O33  1  0.25000000  0.27701700  0.75136100  1.0
  O  O34  1  0.25000000  0.22298300  0.25136100  1.0
  O  O35  1  0.75000000  0.77701700  0.74863900  1.0
  O  O36  1  0.44369100  0.63430500  0.87324700  1.0
  O  O37  1  0.94369100  0.36569500  0.12675300  1.0
  O  O38  1  0.55630900  0.13430500  0.62675300  1.0
  O  O39  1  0.05630900  0.86569500  0.37324700  1.0
  O  O40  1  0.55630900  0.36569500  0.12675300  1.0
  O  O41  1  0.05630900  0.63430500  0.87324700  1.0
  O  O42  1  0.44369100  0.86569500  0.37324700  1.0
  O  O43  1  0.94369100  0.13430500  0.62675300  1.0
  O  O44  1  0.75000000  0.47084100  0.76808200  1.0
  O  O45  1  0.25000000  0.52915900  0.23191800  1.0
  O  O46  1  0.25000000  0.97084100  0.73191800  1.0
  O  O47  1  0.75000000  0.02915900  0.26808200  1.0
  O  O48  1  0.75000000  0.48201200  0.98229600  1.0
  O  O49  1  0.25000000  0.51798800  0.01770400  1.0
  O  O50  1  0.25000000  0.98201200  0.51770400  1.0
  O  O51  1  0.75000000  0.01798800  0.48229600  1.0