# generated using pymatgen
data_Na2NiPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14857400
_cell_length_b   11.07423468
_cell_length_c   11.17065211
_cell_angle_alpha   73.19497280
_cell_angle_beta   88.64773197
_cell_angle_gamma   88.75992648
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2NiPCO7
_chemical_formula_sum   'Na8 Ni4 P4 C4 O28'
_cell_volume   609.46892619
_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  0.24327800  0.13203100  0.11945200  1.0
  Na  Na1  1  0.74934900  0.35219500  0.37937300  1.0
  Na  Na2  1  0.75690700  0.63111000  0.11577500  1.0
  Na  Na3  1  0.21252700  0.31466900  0.59544400  1.0
  Na  Na4  1  0.24903300  0.63826900  0.62337700  1.0
  Na  Na5  1  0.24798200  0.37295100  0.88864900  1.0
  Na  Na6  1  0.24442300  0.86875100  0.38490900  1.0
  Na  Na7  1  0.75872300  0.87355800  0.87740300  1.0
  Ni  Ni8  1  0.78058900  0.04829800  0.29849100  1.0
  Ni  Ni9  1  0.21950100  0.45029300  0.19985300  1.0
  Ni  Ni10  1  0.78013800  0.55153600  0.80116100  1.0
  Ni  Ni11  1  0.21679900  0.95668400  0.69807100  1.0
  P  P12  1  0.71702300  0.33549600  0.08547200  1.0
  P  P13  1  0.28435800  0.16294000  0.41251200  1.0
  P  P14  1  0.71929400  0.83826000  0.58710800  1.0
  P  P15  1  0.28501300  0.66726500  0.91562800  1.0
  C  C16  1  0.28513700  0.08825600  0.83917600  1.0
  C  C17  1  0.28671500  0.58758200  0.33831800  1.0
  C  C18  1  0.71746500  0.91194900  0.16282600  1.0
  C  C19  1  0.71214700  0.41338900  0.65825800  1.0
  O  O20  1  0.78993300  0.19342900  0.12940600  1.0
  O  O21  1  0.13945200  0.08882500  0.33728600  1.0
  O  O22  1  0.41446900  0.35099400  0.10284100  1.0
  O  O23  1  0.58129400  0.14818400  0.38659000  1.0
  O  O24  1  0.85375500  0.41039000  0.16307900  1.0
  O  O25  1  0.20880100  0.61900500  0.05648200  1.0
  O  O26  1  0.22285100  0.11883800  0.55385400  1.0
  O  O27  1  0.21521500  0.30671500  0.37149700  1.0
  O  O28  1  0.48152400  0.53977100  0.28904700  1.0
  O  O29  1  0.47291600  0.03867200  0.78803000  1.0
  O  O30  1  0.05684600  0.06216900  0.80672300  1.0
  O  O31  1  0.06063200  0.55614100  0.30710700  1.0
  O  O32  1  0.68416100  0.34804500  0.58350900  1.0
  O  O33  1  0.68832000  0.84440500  0.09138700  1.0
  O  O34  1  0.32017000  0.15797000  0.90843900  1.0
  O  O35  1  0.31219200  0.65513900  0.41028300  1.0
  O  O36  1  0.94368600  0.94179000  0.19517300  1.0
  O  O37  1  0.94095900  0.44124400  0.69053800  1.0
  O  O38  1  0.51431900  0.45756200  0.70898200  1.0
  O  O39  1  0.52399800  0.96036800  0.21271400  1.0
  O  O40  1  0.78862100  0.38466700  0.94481200  1.0
  O  O41  1  0.79138300  0.88176400  0.44583600  1.0
  O  O42  1  0.78745900  0.69494000  0.63315800  1.0
  O  O43  1  0.15041900  0.59078200  0.83897000  1.0
  O  O44  1  0.41863300  0.85523000  0.60424500  1.0
  O  O45  1  0.58646800  0.65257400  0.90058300  1.0
  O  O46  1  0.86295000  0.91108700  0.66316500  1.0
  O  O47  1  0.20624400  0.80873000  0.86976800  1.0