# generated using pymatgen
data_Na2NiPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.41318700
_cell_length_b   8.45412486
_cell_length_c   8.91174538
_cell_angle_alpha   90.96506096
_cell_angle_beta   91.65482798
_cell_angle_gamma   104.21347690
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2NiPCO7
_chemical_formula_sum   'Na8 Ni4 P4 C4 O28'
_cell_volume   614.01044775
_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  0.88612700  0.86573400  0.26455400  1.0
  Na  Na1  1  0.38308800  0.37561000  0.24977200  1.0
  Na  Na2  1  0.61598900  0.13679400  0.26602400  1.0
  Na  Na3  1  0.12326300  0.63323700  0.24736100  1.0
  Na  Na4  1  0.89280100  0.38120800  0.73812100  1.0
  Na  Na5  1  0.59417500  0.63038800  0.73744400  1.0
  Na  Na6  1  0.12936900  0.13111200  0.74415400  1.0
  Na  Na7  1  0.75273800  0.01851000  0.91067900  1.0
  Ni  Ni8  1  0.98540400  0.23284100  0.34885800  1.0
  Ni  Ni9  1  0.48532100  0.73713700  0.35248800  1.0
  Ni  Ni10  1  0.02187300  0.76634000  0.65270600  1.0
  Ni  Ni11  1  0.51826800  0.26266700  0.65096300  1.0
  P  P12  1  0.76610300  0.51684200  0.42390500  1.0
  P  P13  1  0.26512700  0.01368000  0.42495400  1.0
  P  P14  1  0.73593100  0.98406100  0.57746700  1.0
  P  P15  1  0.23107500  0.47942300  0.57702100  1.0
  C  C16  1  0.52165900  0.76773400  0.07907800  1.0
  C  C17  1  0.01124900  0.26189300  0.07265000  1.0
  C  C18  1  0.98079900  0.73640300  0.92524100  1.0
  C  C19  1  0.48748100  0.23500000  0.92552700  1.0
  O  O20  1  0.96170600  0.72181200  0.06445800  1.0
  O  O21  1  0.47562700  0.22282400  0.06547100  1.0
  O  O22  1  0.40681800  0.65782900  0.13995500  1.0
  O  O23  1  0.89833600  0.15092600  0.13754800  1.0
  O  O24  1  0.61600500  0.86950400  0.17660500  1.0
  O  O25  1  0.11167100  0.36239800  0.16445000  1.0
  O  O26  1  0.32292900  0.88492800  0.32971800  1.0
  O  O27  1  0.82308500  0.38681600  0.32995100  1.0
  O  O28  1  0.63640900  0.57553200  0.32761300  1.0
  O  O29  1  0.13898800  0.07397100  0.32436900  1.0
  O  O30  1  0.80675300  0.05139600  0.42693100  1.0
  O  O31  1  0.29922700  0.55308500  0.42703800  1.0
  O  O32  1  0.91657800  0.66673700  0.45901300  1.0
  O  O33  1  0.41559500  0.16329400  0.46008000  1.0
  O  O34  1  0.58992800  0.83286500  0.54051500  1.0
  O  O35  1  0.08356300  0.32665700  0.54047500  1.0
  O  O36  1  0.19175900  0.94698000  0.57409600  1.0
  O  O37  1  0.69623600  0.44893400  0.57578000  1.0
  O  O38  1  0.86238400  0.92725500  0.68092900  1.0
  O  O39  1  0.16037200  0.59630000  0.67458900  1.0
  O  O40  1  0.68219400  0.11585400  0.67326700  1.0
  O  O41  1  0.36136600  0.42114800  0.67227600  1.0
  O  O42  1  0.88553400  0.64143100  0.82442500  1.0
  O  O43  1  0.39103800  0.13879200  0.82816900  1.0
  O  O44  1  0.60287100  0.34455700  0.86377400  1.0
  O  O45  1  0.09504100  0.84833400  0.86796200  1.0
  O  O46  1  0.54303000  0.77722000  0.94023400  1.0
  O  O47  1  0.01516100  0.26389800  0.93101600  1.0