# generated using pymatgen
data_Li3Fe4(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.64030500
_cell_length_b   8.68119379
_cell_length_c   8.81867241
_cell_angle_alpha   60.60732310
_cell_angle_beta   60.72090707
_cell_angle_gamma   60.50050314
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe4(PO4)6
_chemical_formula_sum   'Li3 Fe4 P6 O24'
_cell_volume   474.16720608
_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  0.96394000  0.82851700  0.55482300  1
  Li  Li1  1  0.63617200  0.34457100  0.05019000  1
  Li  Li2  1  0.10254100  0.29580600  0.34294500  1
  Fe  Fe3  1  0.15194500  0.12920600  0.07094000  1
  Fe  Fe4  1  0.64255100  0.64265200  0.56893900  1
  Fe  Fe5  1  0.84995100  0.86413600  0.93386700  1
  Fe  Fe6  1  0.35708300  0.36350700  0.43542600  1
  P  P7  1  0.24909500  0.54072700  0.74149900  1
  P  P8  1  0.53153800  0.95926100  0.75602400  1
  P  P9  1  0.47268000  0.04149400  0.24140700  1
  P  P10  1  0.03734800  0.74519100  0.25851200  1
  P  P11  1  0.75553200  0.46368900  0.25540900  1
  P  P12  1  0.95801200  0.24487100  0.75254100  1
  O  O13  1  0.99413200  0.19884800  0.92802300  1
  O  O14  1  0.87310400  0.70863600  0.44573100  1
  O  O15  1  0.23552000  0.35628200  0.89873200  1
  O  O16  1  0.53887400  0.79172000  0.72815700  1
  O  O17  1  0.27394500  0.54123500  0.55530400  1
  O  O18  1  0.06444600  0.90736600  0.26256100  1
  O  O19  1  0.38084600  0.96409000  0.94397200  1
  O  O20  1  0.06659800  0.70922100  0.77217000  1
  O  O21  1  0.41453800  0.56866100  0.74026100  1
  O  O22  1  0.76861300  0.41322800  0.76524800  1
  O  O23  1  0.72933900  0.92068700  0.74902300  1
  O  O24  1  0.48608000  0.14729300  0.60333000  1
  O  O25  1  0.50560000  0.85436300  0.39943900  1
  O  O26  1  0.21380800  0.56604800  0.25775300  1
  O  O27  1  0.27726400  0.08078500  0.24116200  1
  O  O28  1  0.60253500  0.41769300  0.25710800  1
  O  O29  1  0.62883800  0.04327300  0.05395600  1
  O  O30  1  0.94855300  0.30722400  0.21845100  1
  O  O31  1  0.94276400  0.07733800  0.74754000  1
  O  O32  1  0.72653300  0.46658100  0.44207200  1
  O  O33  1  0.45531300  0.21116400  0.27231300  1
  O  O34  1  0.75389800  0.65322600  0.09968900  1
  O  O35  1  0.11562600  0.29435100  0.56863500  1
  O  O36  1  0.99129900  0.79703700  0.08949300  1
