# generated using pymatgen
data_Li4NbFe5(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.49821400
_cell_length_b   8.63258245
_cell_length_c   8.64366891
_cell_angle_alpha   63.11385815
_cell_angle_beta   63.46033812
_cell_angle_gamma   63.91735350
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4NbFe5(PO4)6
_chemical_formula_sum   'Li4 Nb1 Fe5 P6 O24'
_cell_volume   483.01865478
_cell_formula_units_Z   1
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  0.74684500  0.14830700  0.35533500  1
  Li  Li1  1  0.29396800  0.84216700  0.64428800  1
  Li  Li2  1  0.64047300  0.29552500  0.84638400  1
  Li  Li3  1  0.84453200  0.63920900  0.29948300  1
  Nb  Nb4  1  0.85083200  0.84660600  0.84968800  1
  Fe  Fe5  1  0.01382100  0.00547700  0.99941300  1
  Fe  Fe6  1  0.35064600  0.35647300  0.34790700  1
  Fe  Fe7  1  0.49128000  0.50188600  0.50086700  1
  Fe  Fe8  1  0.14785000  0.15036700  0.15035300  1
  Fe  Fe9  1  0.65364100  0.65349600  0.65792600  1
  P  P10  1  0.05671400  0.74627800  0.43941700  1
  P  P11  1  0.43890000  0.05471100  0.74724200  1
  P  P12  1  0.74685600  0.43783900  0.05683400  1
  P  P13  1  0.24902800  0.54777800  0.94838600  1
  P  P14  1  0.55938100  0.95173000  0.25111900  1
  P  P15  1  0.93931600  0.24665500  0.54639000  1
  O  O16  1  0.46891000  0.90179500  0.68274900  1
  O  O17  1  0.67904200  0.46918100  0.90536000  1
  O  O18  1  0.90320600  0.67421100  0.47473400  1
  O  O19  1  0.05636400  0.91063900  0.26229100  1
  O  O20  1  0.00522400  0.81273800  0.60491000  1
  O  O21  1  0.24485800  0.60184900  0.43268700  1
  O  O22  1  0.25124400  0.07678900  0.89717500  1
  O  O23  1  0.45583600  0.23482500  0.58922600  1
  O  O24  1  0.17017900  0.40318100  0.98759600  1
  O  O25  1  0.60083600  0.43015100  0.24826400  1
  O  O26  1  0.10399100  0.75014100  0.90794100  1
  O  O27  1  0.40347300  0.00902400  0.17914200  1
  O  O28  1  0.60135600  0.99902500  0.82308900  1
  O  O29  1  0.89473200  0.24922000  0.08093200  1
  O  O30  1  0.40670900  0.56254900  0.75694700  1
  O  O31  1  0.81692700  0.60018800  0.00746600  1
  O  O32  1  0.56265000  0.76168100  0.40741300  1
  O  O33  1  0.76019300  0.90727700  0.10117000  1
  O  O34  1  0.75385600  0.40653800  0.56980200  1
  O  O35  1  0.94799500  0.17836800  0.40699600  1
  O  O36  1  0.91187300  0.09850900  0.74778200  1
  O  O37  1  0.11013400  0.29274400  0.50162000  1
  O  O38  1  0.30825000  0.52412500  0.10067000  1
  O  O39  1  0.55808400  0.09775000  0.30600300  1
