# generated using pymatgen
data_Li2NiPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34305000
_cell_length_b   5.01287600
_cell_length_c   8.43289190
_cell_angle_alpha   86.97634661
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2NiPCO7
_chemical_formula_sum   'Li4 Ni2 P2 C2 O14'
_cell_volume   267.76672266
_cell_formula_units_Z   2
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
  Li  Li0  1  0.00392500  0.78693100  0.76149000  1
  Li  Li1  1  0.99607500  0.21306900  0.23851000  1
  Li  Li2  1  0.50392500  0.21306900  0.23851000  1
  Li  Li3  1  0.49607500  0.78693100  0.76149000  1
  Ni  Ni4  1  0.75000000  0.78249700  0.34706600  1
  Ni  Ni5  1  0.25000000  0.21750300  0.65293400  1
  P  P6  1  0.25000000  0.71567100  0.42282000  1
  P  P7  1  0.75000000  0.28432900  0.57718000  1
  C  C8  1  0.75000000  0.71727900  0.05557900  1
  C  C9  1  0.25000000  0.28272100  0.94442100  1
  O  O10  1  0.75000000  0.50873800  0.15251700  1
  O  O11  1  0.75000000  0.94527800  0.12522000  1
  O  O12  1  0.25000000  0.49126200  0.84748300  1
  O  O13  1  0.94136400  0.18490800  0.67647300  1
  O  O14  1  0.55863600  0.18490800  0.67647300  1
  O  O15  1  0.75000000  0.17430100  0.40900600  1
  O  O16  1  0.25000000  0.82569900  0.59099400  1
  O  O17  1  0.44136400  0.81509200  0.32352700  1
  O  O18  1  0.05863600  0.81509200  0.32352700  1
  O  O19  1  0.25000000  0.40247300  0.44286500  1
  O  O20  1  0.75000000  0.71228500  0.90566900  1
  O  O21  1  0.25000000  0.28771500  0.09433100  1
  O  O22  1  0.75000000  0.59752700  0.55713500  1
  O  O23  1  0.25000000  0.05472200  0.87478000  1
