# generated using pymatgen
data_LiNiP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.32881700
_cell_length_b   5.07854900
_cell_length_c   9.63256906
_cell_angle_alpha   59.50725056
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNiP2O7
_chemical_formula_sum   'Li4 Ni4 P8 O28'
_cell_volume   561.85744587
_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
  Li  Li0  1  0.62859800  0.01392100  0.63981000  1
  Li  Li1  1  0.37140200  0.98607900  0.36019000  1
  Li  Li2  1  0.87140200  0.01392100  0.13981000  1
  Li  Li3  1  0.12859800  0.98607900  0.86019000  1
  Ni  Ni4  1  0.33089900  0.96229000  0.73649400  1
  Ni  Ni5  1  0.16910100  0.96229000  0.23649400  1
  Ni  Ni6  1  0.83089900  0.03771000  0.76350600  1
  Ni  Ni7  1  0.66910100  0.03771000  0.26350600  1
  P  P8  1  0.96772700  0.52753100  0.77531400  1
  P  P9  1  0.53227300  0.52753100  0.27531400  1
  P  P10  1  0.18048800  0.26754600  0.46360300  1
  P  P11  1  0.81951200  0.73245400  0.53639700  1
  P  P12  1  0.68048800  0.73245400  0.03639700  1
  P  P13  1  0.46772700  0.47246900  0.72468600  1
  P  P14  1  0.31951200  0.26754600  0.96360300  1
  P  P15  1  0.03227300  0.47246900  0.22468600  1
  O  O16  1  0.81102500  0.96615400  0.35701300  1
  O  O17  1  0.93736300  0.68233200  0.58341600  1
  O  O18  1  0.77645400  0.42235600  0.57711800  1
  O  O19  1  0.68897500  0.96615400  0.85701300  1
  O  O20  1  0.27069400  0.15171600  0.86069100  1
  O  O21  1  0.22930600  0.15171600  0.36069100  1
  O  O22  1  0.72354600  0.42235600  0.07711800  1
  O  O23  1  0.54228000  0.78306900  0.31500700  1
  O  O24  1  0.22354600  0.57764400  0.42288200  1
  O  O25  1  0.39129000  0.73677400  0.62957900  1
  O  O26  1  0.27645400  0.57764400  0.92288200  1
  O  O27  1  0.72930600  0.84828400  0.13930900  1
  O  O28  1  0.10871000  0.73677400  0.12957900  1
  O  O29  1  0.92874600  0.60529300  0.20506600  1
  O  O30  1  0.07125400  0.39470700  0.79493400  1
  O  O31  1  0.45772000  0.21693100  0.68499300  1
  O  O32  1  0.95772000  0.78306900  0.81500700  1
  O  O33  1  0.57125400  0.60529300  0.70506600  1
  O  O34  1  0.43736300  0.31766800  0.91658400  1
  O  O35  1  0.89129000  0.26322600  0.87042100  1
  O  O36  1  0.31102500  0.03384600  0.14298700  1
  O  O37  1  0.56263700  0.68233200  0.08341600  1
  O  O38  1  0.42874600  0.39470700  0.29493400  1
  O  O39  1  0.06263700  0.31766800  0.41658400  1
  O  O40  1  0.77069400  0.84828400  0.63930900  1
  O  O41  1  0.04228000  0.21693100  0.18499300  1
  O  O42  1  0.18897500  0.03384600  0.64298700  1
  O  O43  1  0.60871000  0.26322600  0.37042100  1
