# generated using pymatgen
data_Na3Ni2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.84816401
_cell_length_b   5.16493923
_cell_length_c   13.03304210
_cell_angle_alpha   89.91667905
_cell_angle_beta   90.90557370
_cell_angle_gamma   88.41933862
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na3Ni2P2(CO7)2
_chemical_formula_sum   'Na6 Ni4 P4 C4 O28'
_cell_volume   595.31094459
_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  0.25078700  0.24516700  0.00150400  1.0
  Na  Na1  1  0.25179000  0.24663400  0.24315700  1.0
  Na  Na2  1  0.25717200  0.24364400  0.51678800  1.0
  Na  Na3  1  0.74282800  0.75635600  0.48321200  1.0
  Na  Na4  1  0.74821000  0.75336600  0.75684300  1.0
  Na  Na5  1  0.74921300  0.75483300  0.99849500  1.0
  Ni  Ni6  1  0.34497900  0.78147400  0.37496900  1.0
  Ni  Ni7  1  0.34238200  0.78266400  0.87061300  1.0
  Ni  Ni8  1  0.65761800  0.21733600  0.12938700  1.0
  Ni  Ni9  1  0.65502100  0.21852600  0.62503100  1.0
  P  P10  1  0.42640400  0.72108500  0.12541500  1.0
  P  P11  1  0.42396000  0.71722800  0.62498800  1.0
  P  P12  1  0.57604000  0.28277200  0.37501200  1.0
  P  P13  1  0.57359600  0.27891500  0.87458500  1.0
  C  C14  1  0.07193700  0.71430700  0.37343100  1.0
  C  C15  1  0.07142900  0.71405400  0.87498800  1.0
  C  C16  1  0.92806300  0.28569300  0.62656900  1.0
  C  C17  1  0.92857100  0.28594600  0.12501200  1.0
  O  O18  1  0.06836700  0.32380100  0.12202000  1.0
  O  O19  1  0.06691600  0.32412000  0.62660000  1.0
  O  O20  1  0.13014200  0.94246800  0.37240800  1.0
  O  O21  1  0.12933600  0.94129100  0.87474400  1.0
  O  O22  1  0.17351200  0.52460900  0.37490200  1.0
  O  O23  1  0.17303700  0.52766300  0.87174900  1.0
  O  O24  1  0.32097100  0.79083000  0.53129500  1.0
  O  O25  1  0.32241900  0.78622400  0.03110300  1.0
  O  O26  1  0.32621100  0.79115400  0.21848300  1.0
  O  O27  1  0.32385700  0.78671400  0.71678200  1.0
  O  O28  1  0.42439500  0.13864200  0.37580100  1.0
  O  O29  1  0.42466900  0.13280600  0.87648000  1.0
  O  O30  1  0.46379800  0.42199100  0.12561600  1.0
  O  O31  1  0.46499800  0.42212300  0.62079300  1.0
  O  O32  1  0.53500200  0.57787700  0.37920700  1.0
  O  O33  1  0.53620200  0.57800900  0.87438400  1.0
  O  O34  1  0.57560500  0.86135800  0.62419900  1.0
  O  O35  1  0.57533100  0.86719400  0.12352000  1.0
  O  O36  1  0.67378900  0.20884600  0.78151700  1.0
  O  O37  1  0.67758100  0.21377600  0.96889700  1.0
  O  O38  1  0.67614300  0.21328600  0.28321800  1.0
  O  O39  1  0.67902900  0.20917000  0.46870500  1.0
  O  O40  1  0.82696300  0.47233700  0.12825100  1.0
  O  O41  1  0.82648800  0.47539100  0.62509800  1.0
  O  O42  1  0.86985700  0.05753200  0.62759200  1.0
  O  O43  1  0.87066400  0.05870800  0.12525600  1.0
  O  O44  1  0.93163300  0.67619900  0.87798000  1.0
  O  O45  1  0.93308400  0.67588000  0.37340000  1.0