# generated using pymatgen
data_LiNi2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.73292120
_cell_length_b   8.73292120
_cell_length_c   6.50523708
_cell_angle_alpha   73.76219726
_cell_angle_beta   73.76219726
_cell_angle_gamma   92.01830947
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi2(PO4)3
_chemical_formula_sum   'Li2 Ni4 P6 O24'
_cell_volume   453.84942859
_cell_formula_units_Z   2
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  0.50000000  0.50000000  0.00000000  1
  Li  Li1  1  0.50000000  0.50000000  0.50000000  1
  Ni  Ni2  1  0.61982100  0.94122000  0.63521500  1
  Ni  Ni3  1  0.05878000  0.38017900  0.86478500  1
  Ni  Ni4  1  0.38017900  0.05878000  0.36478500  1
  Ni  Ni5  1  0.94122000  0.61982100  0.13521500  1
  P  P6  1  0.71124900  0.28875100  0.25000000  1
  P  P7  1  0.28875100  0.71124900  0.75000000  1
  P  P8  1  0.34959700  0.14279700  0.85324200  1
  P  P9  1  0.14279700  0.34959700  0.35324200  1
  P  P10  1  0.65040300  0.85720300  0.14675800  1
  P  P11  1  0.85720300  0.65040300  0.64675800  1
  O  O12  1  0.36039300  0.02750300  0.07726000  1
  O  O13  1  0.26781300  0.54224300  0.72118200  1
  O  O14  1  0.18093400  0.17556300  0.38467500  1
  O  O15  1  0.73218700  0.45775700  0.27881800  1
  O  O16  1  0.68932400  0.55218500  0.71603400  1
  O  O17  1  0.44781500  0.31067600  0.78396600  1
  O  O18  1  0.16398700  0.74130700  0.95292300  1
  O  O19  1  0.45775700  0.73218700  0.77881800  1
  O  O20  1  0.58819500  0.93814400  0.33152800  1
  O  O21  1  0.74130700  0.16398700  0.45292300  1
  O  O22  1  0.55218500  0.68932400  0.21603400  1
  O  O23  1  0.31067600  0.44781500  0.28396600  1
  O  O24  1  0.83601300  0.25869300  0.04707700  1
  O  O25  1  0.97249700  0.63960700  0.42274000  1
  O  O26  1  0.54224300  0.26781300  0.22118200  1
  O  O27  1  0.63960700  0.97249700  0.92274000  1
  O  O28  1  0.82443700  0.81906600  0.11532500  1
  O  O29  1  0.06185600  0.41180500  0.16847200  1
  O  O30  1  0.02750300  0.36039300  0.57726000  1
  O  O31  1  0.25869300  0.83601300  0.54707700  1
  O  O32  1  0.17556300  0.18093400  0.88467500  1
  O  O33  1  0.93814400  0.58819500  0.83152800  1
  O  O34  1  0.41180500  0.06185600  0.66847200  1
  O  O35  1  0.81906600  0.82443700  0.61532500  1
