# generated using pymatgen
data_LiNiP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.30619300
_cell_length_b   7.06205700
_cell_length_c   9.16169022
_cell_angle_alpha   66.25965673
_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   491.93752142
_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  0.44144900  0.30283500  0.32510700  1
  Li  Li1  1  0.94144900  0.69716500  0.17489300  1
  Li  Li2  1  0.55855100  0.69716500  0.67489300  1
  Li  Li3  1  0.05855100  0.30283500  0.82510700  1
  Ni  Ni4  1  0.57613200  0.76164000  0.11485300  1
  Ni  Ni5  1  0.92386800  0.76164000  0.61485300  1
  Ni  Ni6  1  0.42386800  0.23836000  0.88514700  1
  Ni  Ni7  1  0.07613200  0.23836000  0.38514700  1
  P  P8  1  0.76819400  0.05867300  0.25441700  1
  P  P9  1  0.73180600  0.05867300  0.75441700  1
  P  P10  1  0.26845900  0.53056600  0.53183300  1
  P  P11  1  0.73154100  0.46943400  0.46816700  1
  P  P12  1  0.26819400  0.94132700  0.24558300  1
  P  P13  1  0.23180600  0.94132700  0.74558300  1
  P  P14  1  0.23154100  0.53056600  0.03183300  1
  P  P15  1  0.76845900  0.46943400  0.96816700  1
  O  O16  1  0.11117200  0.88991800  0.18466500  1
  O  O17  1  0.89428300  0.43819700  0.40134400  1
  O  O18  1  0.74296600  0.88202600  0.70106200  1
  O  O19  1  0.09649000  0.48049800  0.15719300  1
  O  O20  1  0.39428300  0.56180300  0.09865600  1
  O  O21  1  0.40592500  0.97628100  0.12138600  1
  O  O22  1  0.60571700  0.43819700  0.90134400  1
  O  O23  1  0.66909000  0.25331300  0.60107700  1
  O  O24  1  0.90351000  0.51950200  0.84280700  1
  O  O25  1  0.24296600  0.11797400  0.79893800  1
  O  O26  1  0.25874900  0.37733400  0.45378500  1
  O  O27  1  0.38882800  0.88991800  0.68466500  1
  O  O28  1  0.61117200  0.11008200  0.31533500  1
  O  O29  1  0.16909000  0.74668700  0.89892300  1
  O  O30  1  0.24125100  0.37733400  0.95378500  1
  O  O31  1  0.59649000  0.51950200  0.34280700  1
  O  O32  1  0.75874900  0.62266600  0.04621500  1
  O  O33  1  0.25703400  0.11797400  0.29893800  1
  O  O34  1  0.83091000  0.25331300  0.10107700  1
  O  O35  1  0.74125100  0.62266600  0.54621500  1
  O  O36  1  0.88882800  0.11008200  0.81533500  1
  O  O37  1  0.09407500  0.97628100  0.62138600  1
  O  O38  1  0.10571700  0.56180300  0.59865600  1
  O  O39  1  0.33091000  0.74668700  0.39892300  1
  O  O40  1  0.90592500  0.02371900  0.37861400  1
  O  O41  1  0.75703400  0.88202600  0.20106200  1
  O  O42  1  0.59407500  0.02371900  0.87861400  1
  O  O43  1  0.40351000  0.48049800  0.65719300  1
