# generated using pymatgen
data_Li5Fe3Ni2(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.40658400
_cell_length_b   8.49910672
_cell_length_c   8.51548389
_cell_angle_alpha   61.96077838
_cell_angle_beta   62.34155262
_cell_angle_gamma   62.31270819
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe3Ni2(PO4)6
_chemical_formula_sum   'Li5 Fe3 Ni2 P6 O24'
_cell_volume   451.39194131
_cell_formula_units_Z   1
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
  Li  Li0  1  0.75256600  0.14075100  0.35536500  1
  Li  Li1  1  0.18606500  0.85314500  0.67532200  1
  Li  Li2  1  0.67308200  0.18134700  0.85934000  1
  Li  Li3  1  0.85908100  0.67001100  0.18112000  1
  Li  Li4  1  0.84036300  0.83923200  0.83764600  1
  Fe  Fe5  1  0.14601500  0.14640000  0.14383400  1
  Fe  Fe6  1  0.35399400  0.35724300  0.35408600  1
  Fe  Fe7  1  0.64744700  0.65084300  0.65265900  1
  Ni  Ni8  1  0.00671000  0.99721600  0.99750800  1
  Ni  Ni9  1  0.49266500  0.50146100  0.50290100  1
  P  P10  1  0.75295600  0.45248600  0.05307600  1
  P  P11  1  0.05722600  0.74895800  0.45167500  1
  P  P12  1  0.44570900  0.05392800  0.75837700  1
  P  P13  1  0.25566100  0.54220500  0.95756300  1
  P  P14  1  0.55346600  0.96156000  0.25733400  1
  P  P15  1  0.94671000  0.25216000  0.53746300  1
  O  O16  1  0.10623900  0.33444800  0.45477000  1
  O  O17  1  0.35359200  0.47935400  0.09830300  1
  O  O18  1  0.05466000  0.91192000  0.25893100  1
  O  O19  1  0.53268700  0.10151400  0.33680000  1
  O  O20  1  0.03136000  0.81366900  0.60179100  1
  O  O21  1  0.25326700  0.59180800  0.42494400  1
  O  O22  1  0.24833700  0.06396400  0.91372900  1
  O  O23  1  0.43077300  0.24687900  0.59399100  1
  O  O24  1  0.18354500  0.38839700  0.99664900  1
  O  O25  1  0.60028900  0.42270000  0.25497200  1
  O  O26  1  0.09527800  0.73268400  0.96378500  1
  O  O27  1  0.37719000  0.02079000  0.20691000  1
  O  O28  1  0.59852700  0.02497800  0.82469800  1
  O  O29  1  0.90075200  0.24842600  0.07195900  1
  O  O30  1  0.39459200  0.58120800  0.74886200  1
  O  O31  1  0.81965000  0.60307200  0.02403300  1
  O  O32  1  0.57879800  0.75525800  0.40016600  1
  O  O33  1  0.74002500  0.95546700  0.08867500  1
  O  O34  1  0.74244300  0.39888200  0.58361000  1
  O  O35  1  0.95372600  0.18951500  0.39058700  1
  O  O36  1  0.49047300  0.89170700  0.69352500  1
  O  O37  1  0.96209500  0.09212900  0.72608100  1
  O  O38  1  0.68937300  0.49645300  0.89061300  1
  O  O39  1  0.89261200  0.68283200  0.49934700  1
