# generated using pymatgen
data_Na3Ni2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.49951600
_cell_length_b   8.80231900
_cell_length_c   10.27206498
_cell_angle_alpha   88.37108360
_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   587.43570958
_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  0.98533100  0.74355800  0.87297100  1.0
  Na  Na1  1  0.51246800  0.74436800  0.87574500  1.0
  Na  Na2  1  0.52822300  0.74357500  0.37780100  1.0
  Na  Na3  1  0.02822300  0.25642500  0.62219900  1.0
  Na  Na4  1  0.48533100  0.25644200  0.12702900  1.0
  Na  Na5  1  0.01246800  0.25563200  0.12425500  1.0
  Ni  Ni6  1  0.24539800  0.65747300  0.60673300  1.0
  Ni  Ni7  1  0.24545600  0.65666000  0.11197100  1.0
  Ni  Ni8  1  0.74545600  0.34334000  0.88802900  1.0
  Ni  Ni9  1  0.74539800  0.34252700  0.39326700  1.0
  P  P10  1  0.74927300  0.57493500  0.63990300  1.0
  P  P11  1  0.74824700  0.57651900  0.14033800  1.0
  P  P12  1  0.24824700  0.42348100  0.85966200  1.0
  P  P13  1  0.24927300  0.42506500  0.36009700  1.0
  C  C14  1  0.25365000  0.92968500  0.64293300  1.0
  C  C15  1  0.24910300  0.92823800  0.14400900  1.0
  C  C16  1  0.74910300  0.07176200  0.85599100  1.0
  C  C17  1  0.75365000  0.07031500  0.35706700  1.0
  O  O18  1  0.74951900  0.93148100  0.83990100  1.0
  O  O19  1  0.75299300  0.93195000  0.33568800  1.0
  O  O20  1  0.25548700  0.87278100  0.52876900  1.0
  O  O21  1  0.24650500  0.86746700  0.02979400  1.0
  O  O22  1  0.25113500  0.82611500  0.73731600  1.0
  O  O23  1  0.25130400  0.82727100  0.23829800  1.0
  O  O24  1  0.93523500  0.68022800  0.61321600  1.0
  O  O25  1  0.56210800  0.67592600  0.60471700  1.0
  O  O26  1  0.93461600  0.67564000  0.10108000  1.0
  O  O27  1  0.56127800  0.67780000  0.10395000  1.0
  O  O28  1  0.24765100  0.57487800  0.93358300  1.0
  O  O29  1  0.25698900  0.57411500  0.43259600  1.0
  O  O30  1  0.74575300  0.53681300  0.79037100  1.0
  O  O31  1  0.74212400  0.53370100  0.28756100  1.0
  O  O32  1  0.24212400  0.46629900  0.71243900  1.0
  O  O33  1  0.24575300  0.46318700  0.20962900  1.0
  O  O34  1  0.75698900  0.42588500  0.56740400  1.0
  O  O35  1  0.74765100  0.42512200  0.06641700  1.0
  O  O36  1  0.43461600  0.32436000  0.89892000  1.0
  O  O37  1  0.06127800  0.32220000  0.89605000  1.0
  O  O38  1  0.43523500  0.31977200  0.38678400  1.0
  O  O39  1  0.06210800  0.32407400  0.39528300  1.0
  O  O40  1  0.75130400  0.17272900  0.76170200  1.0
  O  O41  1  0.75113500  0.17388500  0.26268400  1.0
  O  O42  1  0.74650500  0.13253300  0.97020600  1.0
  O  O43  1  0.75548700  0.12721900  0.47123100  1.0
  O  O44  1  0.25299300  0.06805000  0.66431200  1.0
  O  O45  1  0.24951900  0.06851900  0.16009900  1.0