# generated using pymatgen
data_Na3Ni2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.50215600
_cell_length_b   10.22929700
_cell_length_c   10.30303751
_cell_angle_alpha   61.52371810
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na3Ni2P2(CO7)2
_chemical_formula_sum   'Na6 Ni4 P4 C4 O28'
_cell_volume   602.37164942
_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
  Na  Na0  1  0.53734200  0.24850700  0.75743400  1.0
  Na  Na1  1  0.01224200  0.75449500  0.74221100  1.0
  Na  Na2  1  0.48470000  0.75168300  0.74831100  1.0
  Na  Na3  1  0.98470000  0.24831700  0.25168900  1.0
  Na  Na4  1  0.51224200  0.24550500  0.25778900  1.0
  Na  Na5  1  0.03734200  0.75149300  0.24256600  1.0
  Ni  Ni6  1  0.24395600  0.34513100  0.93212700  1.0
  Ni  Ni7  1  0.74491900  0.64895200  0.56493500  1.0
  Ni  Ni8  1  0.24491900  0.35104800  0.43506500  1.0
  Ni  Ni9  1  0.74395600  0.65486900  0.06787300  1.0
  P  P10  1  0.74778600  0.42516500  0.93225800  1.0
  P  P11  1  0.24661800  0.56948200  0.57630800  1.0
  P  P12  1  0.74661800  0.43051800  0.42369200  1.0
  P  P13  1  0.24778600  0.57483500  0.06774200  1.0
  C  C14  1  0.75505400  0.92177700  0.89558900  1.0
  C  C15  1  0.74980500  0.91855200  0.39920800  1.0
  C  C16  1  0.24980500  0.08144800  0.60079200  1.0
  C  C17  1  0.25505400  0.07822300  0.10441100  1.0
  O  O18  1  0.25717200  0.13278800  0.96229400  1.0
  O  O19  1  0.93558000  0.32474000  0.95349800  1.0
  O  O20  1  0.56097400  0.32729900  0.94154400  1.0
  O  O21  1  0.25440800  0.41931300  0.71929500  1.0
  O  O22  1  0.74015300  0.46284300  0.55679000  1.0
  O  O23  1  0.24042700  0.53919100  0.93542200  1.0
  O  O24  1  0.75036900  0.57368400  0.78619300  1.0
  O  O25  1  0.05930400  0.66729600  0.56731700  1.0
  O  O26  1  0.43309200  0.66828200  0.56709900  1.0
  O  O27  1  0.75195900  0.81873900  0.85360100  1.0
  O  O28  1  0.75551700  0.82010800  0.35361400  1.0
  O  O29  1  0.74438900  0.85824300  0.54332700  1.0
  O  O30  1  0.24985600  0.94301400  0.68487700  1.0
  O  O31  1  0.25422400  0.94235000  0.19476400  1.0
  O  O32  1  0.75422400  0.05765000  0.80523600  1.0
  O  O33  1  0.74985600  0.05698600  0.31512300  1.0
  O  O34  1  0.24438900  0.14175700  0.45667300  1.0
  O  O35  1  0.25551700  0.17989200  0.64638600  1.0
  O  O36  1  0.25195900  0.18126100  0.14639900  1.0
  O  O37  1  0.93309200  0.33171800  0.43290100  1.0
  O  O38  1  0.55930400  0.33270400  0.43268300  1.0
  O  O39  1  0.25036900  0.42631600  0.21380700  1.0
  O  O40  1  0.74042700  0.46080900  0.06457800  1.0
  O  O41  1  0.24015300  0.53715700  0.44321000  1.0
  O  O42  1  0.75440800  0.58068700  0.28070500  1.0
  O  O43  1  0.43558000  0.67526000  0.04650200  1.0
  O  O44  1  0.06097400  0.67270100  0.05845600  1.0
  O  O45  1  0.75717200  0.86721200  0.03770600  1.0