# generated using pymatgen
data_Na2NiPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.17771639
_cell_length_b   10.45155401
_cell_length_c   8.40333811
_cell_angle_alpha   108.54037108
_cell_angle_beta   72.36006919
_cell_angle_gamma   60.21411816
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2NiPCO7
_chemical_formula_sum   'Na8 Ni4 P4 C4 O28'
_cell_volume   609.26232921
_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  0.75110400  0.98247700  0.48140700  1.0
  Na  Na1  1  0.99528700  0.75595000  0.00713800  1.0
  Na  Na2  1  0.73785200  0.52324600  0.51048200  1.0
  Na  Na3  1  0.49669300  0.75813600  0.99979000  1.0
  Na  Na4  1  0.79014700  0.30064900  0.73478700  1.0
  Na  Na5  1  0.48244800  0.25261300  0.01621600  1.0
  Na  Na6  1  0.25134400  0.50240600  0.49339300  1.0
  Na  Na7  1  0.03845000  0.22420800  0.96138300  1.0
  Ni  Ni8  1  0.83970400  0.81070900  0.75146800  1.0
  Ni  Ni9  1  0.65172100  0.69566900  0.25415400  1.0
  Ni  Ni10  1  0.34117500  0.30783300  0.74886900  1.0
  Ni  Ni11  1  0.15560300  0.19377000  0.25682500  1.0
  P  P12  1  0.48018600  0.93950800  0.75190000  1.0
  P  P13  1  0.97358600  0.44961400  0.75252800  1.0
  P  P14  1  0.02215700  0.55412100  0.24801100  1.0
  P  P15  1  0.52092300  0.05534700  0.25235000  1.0
  C  C16  1  0.94063700  0.98272900  0.75329800  1.0
  C  C17  1  0.55583500  0.51631000  0.24362300  1.0
  C  C18  1  0.45547500  0.47346600  0.74905200  1.0
  C  C19  1  0.04823600  0.02401300  0.25333500  1.0
  O  O20  1  0.99111800  0.94096300  0.25376100  1.0
  O  O21  1  0.69899700  0.97663800  0.06446900  1.0
  O  O22  1  0.98199600  0.59425500  0.75455600  1.0
  O  O23  1  0.85687700  0.68809200  0.24632500  1.0
  O  O24  1  0.64604000  0.80986300  0.75835400  1.0
  O  O25  1  0.51805300  0.90788400  0.24526700  1.0
  O  O26  1  0.50347100  0.82125200  0.56191500  1.0
  O  O27  1  0.79268800  0.52865600  0.93677900  1.0
  O  O28  1  0.97788900  0.34979700  0.56664600  1.0
  O  O29  1  0.19185200  0.97688300  0.25471100  1.0
  O  O30  1  0.70173600  0.47003200  0.24163600  1.0
  O  O31  1  0.47085300  0.65946200  0.24580400  1.0
  O  O32  1  0.96401600  0.16992200  0.25806500  1.0
  O  O33  1  0.52111500  0.55028200  0.75091300  1.0
  O  O34  1  0.50456400  0.42814200  0.24041900  1.0
  O  O35  1  0.02545000  0.83739000  0.74890800  1.0
  O  O36  1  0.53610200  0.32784400  0.74755100  1.0
  O  O37  1  0.30987200  0.52811400  0.74837900  1.0
  O  O38  1  0.79758300  0.02691700  0.74741200  1.0
  O  O39  1  0.01177400  0.65771200  0.43677300  1.0
  O  O40  1  0.20288500  0.46971200  0.06047200  1.0
  O  O41  1  0.51411500  0.15682700  0.43878600  1.0
  O  O42  1  0.48569300  0.08370500  0.74824600  1.0
  O  O43  1  0.35343900  0.19190800  0.25549100  1.0
  O  O44  1  0.13731300  0.32072600  0.75696400  1.0
  O  O45  1  0.01441400  0.40901300  0.24616800  1.0
  O  O46  1  0.30211800  0.02346100  0.94194800  1.0
  O  O47  1  0.98653300  0.07497600  0.76343000  1.0