# generated using pymatgen
data_Li5Ni6(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.33505800
_cell_length_b   8.40312877
_cell_length_c   10.05845945
_cell_angle_alpha   107.80677283
_cell_angle_beta   90.45635073
_cell_angle_gamma   92.73355301
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Ni6(P2O7)4
_chemical_formula_sum   'Li5 Ni6 P8 O28'
_cell_volume   509.07995658
_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  0.01874900  0.16509700  0.60879200  1
  Li  Li1  1  0.09476400  0.60813300  0.12342200  1
  Li  Li2  1  0.50000000  0.50000000  0.50000000  1
  Li  Li3  1  0.90523600  0.39186700  0.87657800  1
  Li  Li4  1  0.98125100  0.83490300  0.39120800  1
  Ni  Ni5  1  0.00000000  0.50000000  0.50000000  1
  Ni  Ni6  1  0.30740500  0.88778000  0.64099900  1
  Ni  Ni7  1  0.35627000  0.88299100  0.06106000  1
  Ni  Ni8  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni9  1  0.64373000  0.11700900  0.93894000  1
  Ni  Ni10  1  0.69259500  0.11222000  0.35900100  1
  P  P11  1  0.15184100  0.20589600  0.01617100  1
  P  P12  1  0.18819100  0.17849700  0.30951800  1
  P  P13  1  0.26541300  0.54102700  0.74131300  1
  P  P14  1  0.47585700  0.75588700  0.32042600  1
  P  P15  1  0.52414300  0.24411300  0.67957400  1
  P  P16  1  0.73458700  0.45897300  0.25868700  1
  P  P17  1  0.81180900  0.82150300  0.69048200  1
  P  P18  1  0.84815900  0.79410400  0.98382900  1
  O  O19  1  0.04501300  0.83882700  0.07806200  1
  O  O20  1  0.01701400  0.08394800  0.36898100  1
  O  O21  1  0.07280000  0.42346700  0.73106600  1
  O  O22  1  0.07930400  0.19988100  0.16802500  1
  O  O23  1  0.22342200  0.38635900  0.02620600  1
  O  O24  1  0.24507800  0.35142200  0.40782400  1
  O  O25  1  0.25833000  0.65080300  0.64424500  1
  O  O26  1  0.30121100  0.80977400  0.42478900  1
  O  O27  1  0.34254100  0.63661500  0.89093800  1
  O  O28  1  0.32488100  0.12898000  0.65129500  1
  O  O29  1  0.32653200  0.07796600  0.96954600  1
  O  O30  1  0.39385600  0.70965500  0.16632800  1
  O  O31  1  0.38622700  0.07619500  0.26020600  1
  O  O32  1  0.45898400  0.42285200  0.66869000  1
  O  O33  1  0.54101600  0.57714800  0.33131000  1
  O  O34  1  0.61377300  0.92380500  0.73979400  1
  O  O35  1  0.60614400  0.29034500  0.83367200  1
  O  O36  1  0.67346800  0.92203400  0.03045400  1
  O  O37  1  0.67511900  0.87102000  0.34870500  1
  O  O38  1  0.65745900  0.36338500  0.10906200  1
  O  O39  1  0.69878900  0.19022600  0.57521100  1
  O  O40  1  0.74167000  0.34919700  0.35575500  1
  O  O41  1  0.75492200  0.64857800  0.59217600  1
  O  O42  1  0.77657800  0.61364100  0.97379400  1
  O  O43  1  0.92069600  0.80011900  0.83197500  1
  O  O44  1  0.92720000  0.57653300  0.26893400  1
  O  O45  1  0.98298600  0.91605200  0.63101900  1
  O  O46  1  0.95498700  0.16117300  0.92193800  1
