# generated using pymatgen
data_Na2NiPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.09848388
_cell_length_b   10.32168703
_cell_length_c   6.66640153
_cell_angle_alpha   90.48000207
_cell_angle_beta   90.24369473
_cell_angle_gamma   60.59041195
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2NiPCO7
_chemical_formula_sum   'Na8 Ni4 P4 C4 O28'
_cell_volume   605.29470928
_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  0.00721500  0.25988100  0.48177400  1.0
  Na  Na1  1  0.00575300  0.26060300  0.01704400  1.0
  Na  Na2  1  0.48873400  0.25360600  0.98985000  1.0
  Na  Na3  1  0.49070500  0.25012500  0.51309900  1.0
  Na  Na4  1  0.85620100  0.05533300  0.73635700  1.0
  Na  Na5  1  0.50571200  0.74955500  0.01048600  1.0
  Na  Na6  1  0.50516500  0.74964900  0.48783300  1.0
  Na  Na7  1  0.99965600  0.73428400  0.97976600  1.0
  Ni  Ni8  1  0.28327500  0.06412100  0.75073800  1.0
  Ni  Ni9  1  0.21499200  0.43911900  0.25571300  1.0
  Ni  Ni10  1  0.78627300  0.56117600  0.74966100  1.0
  Ni  Ni11  1  0.71954900  0.93562500  0.25367600  1.0
  P  P12  1  0.35041500  0.07007800  0.24995500  1.0
  P  P13  1  0.15067900  0.43010300  0.75111000  1.0
  P  P14  1  0.85026100  0.57311800  0.25096700  1.0
  P  P15  1  0.64590200  0.93385800  0.74993500  1.0
  C  C16  1  0.82119100  0.10988400  0.24738100  1.0
  C  C17  1  0.32037700  0.60790500  0.25070000  1.0
  C  C18  1  0.68043400  0.38776500  0.74980700  1.0
  C  C19  1  0.18033900  0.89188900  0.75246700  1.0
  O  O20  1  0.09763200  0.03759000  0.74833500  1.0
  O  O21  1  0.26664600  0.05710800  0.06367700  1.0
  O  O22  1  0.26764300  0.05858100  0.43673000  1.0
  O  O23  1  0.14312700  0.28299500  0.75256600  1.0
  O  O24  1  0.01905200  0.44133400  0.25034500  1.0
  O  O25  1  0.47650800  0.06530200  0.75745000  1.0
  O  O26  1  0.35548200  0.21810500  0.24969700  1.0
  O  O27  1  0.23341600  0.44383400  0.93858700  1.0
  O  O28  1  0.23607500  0.43667000  0.56500600  1.0
  O  O29  1  0.67573000  0.15437600  0.25033800  1.0
  O  O30  1  0.17602200  0.65295800  0.24965600  1.0
  O  O31  1  0.40325400  0.46363600  0.25477600  1.0
  O  O32  1  0.62613900  0.29998400  0.75194500  1.0
  O  O33  1  0.11889400  0.81257400  0.75974900  1.0
  O  O34  1  0.87383000  0.19784600  0.24770200  1.0
  O  O35  1  0.37571100  0.69314100  0.24801800  1.0
  O  O36  1  0.59870300  0.53090500  0.74934400  1.0
  O  O37  1  0.82708700  0.33648200  0.74778900  1.0
  O  O38  1  0.32555800  0.84422700  0.74903400  1.0
  O  O39  1  0.76934700  0.55373800  0.06463700  1.0
  O  O40  1  0.76873900  0.55824400  0.43701800  1.0
  O  O41  1  0.64293100  0.78641500  0.74847000  1.0
  O  O42  1  0.51884800  0.93936700  0.24887800  1.0
  O  O43  1  0.98261300  0.55775500  0.75588900  1.0
  O  O44  1  0.85424200  0.71972600  0.24394000  1.0
  O  O45  1  0.71893500  0.96004400  0.56324000  1.0
  O  O46  1  0.73231400  0.94937600  0.93296600  1.0
  O  O47  1  0.90550500  0.96688300  0.24605200  1.0