# generated using pymatgen
data_Na2NiPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.92465347
_cell_length_b   5.16197126
_cell_length_c   13.17509371
_cell_angle_alpha   90.13247821
_cell_angle_beta   90.44361320
_cell_angle_gamma   88.60795980
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2NiPCO7
_chemical_formula_sum   'Na8 Ni4 P4 C4 O28'
_cell_volume   606.76213255
_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
  Na  Na0  1  0.25667400  0.24643600  0.00630800  1.0
  Na  Na1  1  0.24976300  0.24205400  0.24425400  1.0
  Na  Na2  1  0.25350100  0.24553000  0.50490200  1.0
  Na  Na3  1  0.26326800  0.24999900  0.74308500  1.0
  Na  Na4  1  0.74840900  0.75704400  0.25718700  1.0
  Na  Na5  1  0.75495400  0.76143100  0.50000700  1.0
  Na  Na6  1  0.73367300  0.74907800  0.98707500  1.0
  Na  Na7  1  0.90798700  0.21186000  0.85769000  1.0
  Ni  Ni8  1  0.35294900  0.78312800  0.37528300  1.0
  Ni  Ni9  1  0.34699200  0.78189700  0.87475900  1.0
  Ni  Ni10  1  0.64941300  0.21696700  0.12547700  1.0
  Ni  Ni11  1  0.65233900  0.21485500  0.62834100  1.0
  P  P12  1  0.42260800  0.71446400  0.12507800  1.0
  P  P13  1  0.42393100  0.71840000  0.62525700  1.0
  P  P14  1  0.57844100  0.28563000  0.37650500  1.0
  P  P15  1  0.57655800  0.28673400  0.87505600  1.0
  C  C16  1  0.07501500  0.71929600  0.37456400  1.0
  C  C17  1  0.07111900  0.71388500  0.87781200  1.0
  C  C18  1  0.93318200  0.28217400  0.62329400  1.0
  C  C19  1  0.92563700  0.28430500  0.12517800  1.0
  O  O20  1  0.06525100  0.30985700  0.12273100  1.0
  O  O21  1  0.07242900  0.31949300  0.62534200  1.0
  O  O22  1  0.13780100  0.94436100  0.37362400  1.0
  O  O23  1  0.12671300  0.94601400  0.87542300  1.0
  O  O24  1  0.17014000  0.52405100  0.37409900  1.0
  O  O25  1  0.16982200  0.52175700  0.87402500  1.0
  O  O26  1  0.32586000  0.79161800  0.53094600  1.0
  O  O27  1  0.32505900  0.79001400  0.03164200  1.0
  O  O28  1  0.32980300  0.79063500  0.21970500  1.0
  O  O29  1  0.32790500  0.79722800  0.71843900  1.0
  O  O30  1  0.42456600  0.15275900  0.37541900  1.0
  O  O31  1  0.42669400  0.14347700  0.87646700  1.0
  O  O32  1  0.45289300  0.41244800  0.12477100  1.0
  O  O33  1  0.45352400  0.41742800  0.62539100  1.0
  O  O34  1  0.54886300  0.58769400  0.37636100  1.0
  O  O35  1  0.53844600  0.58227400  0.88084300  1.0
  O  O36  1  0.57496200  0.85590800  0.62278100  1.0
  O  O37  1  0.57570200  0.84889900  0.12417200  1.0
  O  O38  1  0.67231300  0.22342600  0.78087300  1.0
  O  O39  1  0.67988100  0.21153900  0.96709900  1.0
  O  O40  1  0.67247200  0.20871100  0.28239000  1.0
  O  O41  1  0.67253600  0.20886000  0.47121600  1.0
  O  O42  1  0.82949300  0.47815400  0.12589000  1.0
  O  O43  1  0.83365600  0.46966400  0.62340200  1.0
  O  O44  1  0.87588300  0.05419300  0.62539400  1.0
  O  O45  1  0.86333300  0.05820700  0.12536600  1.0
  O  O46  1  0.93214200  0.67624700  0.88309500  1.0
  O  O47  1  0.93511900  0.69398400  0.37606400  1.0