# generated using pymatgen
data_Li2Ni(PO3)5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.01019248
_cell_length_b   7.01019248
_cell_length_c   13.54942480
_cell_angle_alpha   82.98232222
_cell_angle_beta   82.98232222
_cell_angle_gamma   113.04313042
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Ni(PO3)5
_chemical_formula_sum   'Li4 Ni2 P10 O30'
_cell_volume   597.51057243
_cell_formula_units_Z   2
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  0.74324800  0.25071100  0.71145600  1
  Li  Li1  1  0.25071100  0.74324800  0.21145600  1
  Li  Li2  1  0.20080700  0.37644600  0.61582400  1
  Li  Li3  1  0.37644600  0.20080700  0.11582400  1
  Ni  Ni4  1  0.15624300  0.90024900  0.77437000  1
  Ni  Ni5  1  0.90024900  0.15624300  0.27437000  1
  P  P6  1  0.34729700  0.96270400  0.52990400  1
  P  P7  1  0.71570600  0.61086000  0.54988900  1
  P  P8  1  0.62625300  0.81911500  0.82849400  1
  P  P9  1  0.96270400  0.34729700  0.02990400  1
  P  P10  1  0.61086000  0.71570600  0.04988900  1
  P  P11  1  0.81911500  0.62625300  0.32849400  1
  P  P12  1  0.82333900  0.09268200  0.52219200  1
  P  P13  1  0.09268200  0.82333900  0.02219200  1
  P  P14  1  0.22598200  0.44641100  0.82291100  1
  P  P15  1  0.44641100  0.22598200  0.32291100  1
  O  O16  1  0.84448900  0.83965300  0.79429400  1
  O  O17  1  0.83965300  0.84448900  0.29429400  1
  O  O18  1  0.77210100  0.51392000  0.63972200  1
  O  O19  1  0.51392000  0.77210100  0.13972200  1
  O  O20  1  0.78586300  0.85211600  0.55284900  1
  O  O21  1  0.85211600  0.78586300  0.05284900  1
  O  O22  1  0.59817100  0.84546100  0.94736000  1
  O  O23  1  0.84546100  0.59817100  0.44736000  1
  O  O24  1  0.54741400  0.96688200  0.77457600  1
  O  O25  1  0.96688200  0.54741400  0.27457600  1
  O  O26  1  0.74876800  0.29931900  0.00261300  1
  O  O27  1  0.29931900  0.74876800  0.50261300  1
  O  O28  1  0.17803000  0.92526500  0.91419900  1
  O  O29  1  0.48188100  0.51007600  0.54900300  1
  O  O30  1  0.92526500  0.17803000  0.41419900  1
  O  O31  1  0.46824900  0.57665700  0.83312600  1
  O  O32  1  0.51007600  0.48188100  0.04900300  1
  O  O33  1  0.57665700  0.46824900  0.33312600  1
  O  O34  1  0.92600900  0.20640500  0.60057800  1
  O  O35  1  0.20640500  0.92600900  0.10057800  1
  O  O36  1  0.58765500  0.07871700  0.54168700  1
  O  O37  1  0.07871700  0.58765500  0.04168700  1
  O  O38  1  0.12708200  0.59293100  0.78800600  1
  O  O39  1  0.59293100  0.12708200  0.28800600  1
  O  O40  1  0.12063900  0.32636800  0.93913000  1
  O  O41  1  0.32636800  0.12063900  0.43913000  1
  O  O42  1  0.21959800  0.28258800  0.76010300  1
  O  O43  1  0.28258800  0.21959800  0.26010300  1
  O  O44  1  0.21668400  0.97773500  0.62351300  1
  O  O45  1  0.97773500  0.21668400  0.12351300  1
