# generated using pymatgen
data_LiNiP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.40817000
_cell_length_b   7.00695300
_cell_length_c   9.24196874
_cell_angle_alpha   67.92490137
_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   504.58068606
_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  0.57090800  0.22611600  0.89948600  1
  Li  Li1  1  0.07090800  0.77388400  0.60051400  1
  Li  Li2  1  0.92909200  0.22611600  0.39948700  1
  Li  Li3  1  0.42909200  0.77388400  0.10051400  1
  Ni  Ni4  1  0.93358600  0.30645800  0.81736200  1
  Ni  Ni5  1  0.43358600  0.69354200  0.68263800  1
  Ni  Ni6  1  0.56641400  0.30645800  0.31736200  1
  Ni  Ni7  1  0.06641400  0.69354200  0.18263800  1
  P  P8  1  0.72049400  0.53027300  0.53209200  1
  P  P9  1  0.22049400  0.46972700  0.96790800  1
  P  P10  1  0.73430200  0.93821800  0.24618500  1
  P  P11  1  0.23430200  0.06178200  0.25381500  1
  P  P12  1  0.76569800  0.93821800  0.74618500  1
  P  P13  1  0.26569800  0.06178200  0.75381500  1
  P  P14  1  0.77950600  0.53027300  0.03209200  1
  P  P15  1  0.27950600  0.46972700  0.46790800  1
  O  O16  1  0.58565100  0.49612700  0.65119100  1
  O  O17  1  0.88332700  0.53472300  0.60702600  1
  O  O18  1  0.77368200  0.37625600  0.95135900  1
  O  O19  1  0.27368200  0.62374400  0.54864100  1
  O  O20  1  0.38332700  0.46527700  0.89297400  1
  O  O21  1  0.68217000  0.75407400  0.40507100  1
  O  O22  1  0.08565100  0.50387300  0.84880900  1
  O  O23  1  0.24151000  0.87429500  0.20785700  1
  O  O24  1  0.89870000  0.89068200  0.19669100  1
  O  O25  1  0.60659700  0.95735600  0.12439600  1
  O  O26  1  0.81783000  0.75407400  0.90507100  1
  O  O27  1  0.10659700  0.04264400  0.37560400  1
  O  O28  1  0.25849000  0.87429500  0.70785700  1
  O  O29  1  0.60130000  0.89068200  0.69669100  1
  O  O30  1  0.39870000  0.10931800  0.30330900  1
  O  O31  1  0.74151000  0.12570500  0.29214300  1
  O  O32  1  0.89340300  0.95735600  0.62439600  1
  O  O33  1  0.18217000  0.24592600  0.09492900  1
  O  O34  1  0.39340300  0.04264400  0.87560400  1
  O  O35  1  0.10130000  0.10931800  0.80330900  1
  O  O36  1  0.75849000  0.12570500  0.79214300  1
  O  O37  1  0.91434900  0.49612700  0.15119100  1
  O  O38  1  0.31783000  0.24592600  0.59492900  1
  O  O39  1  0.61667300  0.53472300  0.10702600  1
  O  O40  1  0.72631800  0.37625600  0.45135900  1
  O  O41  1  0.22631800  0.62374400  0.04864100  1
  O  O42  1  0.11667300  0.46527700  0.39297400  1
  O  O43  1  0.41434900  0.50387300  0.34880900  1
