# generated using pymatgen
data_Li3Ni2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.74895035
_cell_length_b   9.77668369
_cell_length_c   9.77668374
_cell_angle_alpha   86.32193302
_cell_angle_beta   86.60847126
_cell_angle_gamma   86.60846799
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ni2(PO4)3
_chemical_formula_sum   'Li12 Ni8 P12 O48'
_cell_volume   926.85651673
_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  0.35101600  0.77256200  0.45005900  1
  Li  Li1  1  0.28663000  0.81667200  0.98085700  1
  Li  Li2  1  0.46517100  0.34686100  0.76956500  1
  Li  Li3  1  0.14898400  0.04994100  0.72743800  1
  Li  Li4  1  0.21337000  0.51914300  0.68332800  1
  Li  Li5  1  0.84603700  0.96564900  0.26628000  1
  Li  Li6  1  0.72759000  0.16308800  0.02513600  1
  Li  Li7  1  0.77241000  0.47486400  0.33691200  1
  Li  Li8  1  0.03482900  0.73043500  0.15313900  1
  Li  Li9  1  0.65396300  0.23372000  0.53435100  1
  Li  Li10  1  0.49452300  0.51315600  0.45887500  1
  Li  Li11  1  0.00547700  0.04112500  0.98684400  1
  Ni  Ni12  1  0.03653500  0.25504300  0.47204000  1
  Ni  Ni13  1  0.75000000  0.53191200  0.96808800  1
  Ni  Ni14  1  0.96895800  0.75112000  0.53466800  1
  Ni  Ni15  1  0.46346500  0.02796000  0.24495700  1
  Ni  Ni16  1  0.53104200  0.96533200  0.74888000  1
  Ni  Ni17  1  0.25000000  0.24860800  0.25139200  1
  Ni  Ni18  1  0.75000000  0.74926500  0.75073500  1
  Ni  Ni19  1  0.25000000  0.46514000  0.03486000  1
  P  P20  1  0.04991500  0.67235300  0.85617700  1
  P  P21  1  0.35653300  0.17052500  0.54655700  1
  P  P22  1  0.95285400  0.32482400  0.15409300  1
  P  P23  1  0.17467200  0.54854600  0.35262200  1
  P  P24  1  0.67171300  0.85507900  0.04477500  1
  P  P25  1  0.45008500  0.64382300  0.82764700  1
  P  P26  1  0.85279100  0.04914700  0.67595500  1
  P  P27  1  0.64720900  0.82404500  0.45085300  1
  P  P28  1  0.32532800  0.14737800  0.95145400  1
  P  P29  1  0.82828700  0.45522500  0.64492100  1
  P  P30  1  0.14346700  0.95344300  0.32947500  1
  P  P31  1  0.54714600  0.34590700  0.17517600  1
  O  O32  1  0.12205100  0.11393400  0.33588800  1
  O  O33  1  0.32954400  0.12214000  0.11194900  1
  O  O34  1  0.17045600  0.38805100  0.37786000  1
  O  O35  1  0.61539900  0.39332300  0.03460700  1
  O  O36  1  0.80284900  0.80653400  0.40736000  1
  O  O37  1  0.72270300  0.41402600  0.54707700  1
  O  O38  1  0.60183200  0.96473800  0.38117700  1
  O  O39  1  0.38681900  0.37638300  0.17088900  1
  O  O40  1  0.03249300  0.61639200  0.39669800  1
  O  O41  1  0.38118300  0.60739000  0.97153100  1
  O  O42  1  0.58599100  0.18852200  0.18299100  1
  O  O43  1  0.94186800  0.08105100  0.79192700  1
  O  O44  1  0.11318100  0.32911100  0.12361700  1
  O  O45  1  0.45156400  0.27890500  0.58799700  1
  O  O46  1  0.91400900  0.31700900  0.31147800  1
  O  O47  1  0.37794900  0.16411200  0.38606600  1
  O  O48  1  0.59378300  0.41509200  0.29849000  1
  O  O49  1  0.39264000  0.02579200  0.61319500  1
  O  O50  1  0.88885200  0.66500400  0.87667900  1
  O  O51  1  0.88460100  0.46539300  0.10667700  1
  O  O52  1  0.79199100  0.41080600  0.79654500  1
  O  O53  1  0.18853100  0.59016200  0.19642400  1
  O  O54  1  0.90621700  0.20151000  0.08490800  1
  O  O55  1  0.40815300  0.54859700  0.72044300  1
  O  O56  1  0.87563800  0.88804100  0.66617800  1
  O  O57  1  0.83276200  0.61668300  0.62324500  1
  O  O58  1  0.77729700  0.95292300  0.08597400  1
  O  O59  1  0.61114800  0.62332100  0.83499600  1
  O  O60  1  0.66723800  0.87675500  0.88331700  1
  O  O61  1  0.70800900  0.70345500  0.08919400  1
  O  O62  1  0.97514100  0.39514600  0.60782200  1
  O  O63  1  0.46750700  0.10330200  0.88360800  1
  O  O64  1  0.52485900  0.89217800  0.10485400  1
  O  O65  1  0.40700500  0.79830600  0.80223200  1
  O  O66  1  0.31146900  0.30357600  0.90983800  1
  O  O67  1  0.29033700  0.59000500  0.43837400  1
  O  O68  1  0.29720900  0.90819400  0.30059900  1
  O  O69  1  0.89816800  0.11882300  0.53526200  1
  O  O70  1  0.11881700  0.52846900  0.89261000  1
  O  O71  1  0.69715100  0.09264000  0.69346600  1
  O  O72  1  0.20966300  0.06162600  0.90999500  1
  O  O73  1  0.09184700  0.77955700  0.95140300  1
  O  O74  1  0.09299500  0.69776800  0.70169400  1
  O  O75  1  0.04843600  0.91200300  0.22109500  1
  O  O76  1  0.62436200  0.83382200  0.61195900  1
  O  O77  1  0.10736000  0.88680500  0.47420800  1
  O  O78  1  0.55813200  0.70807300  0.41894900  1
  O  O79  1  0.20279100  0.19940100  0.59180600  1
