# generated using pymatgen
data_Li3Fe2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.25822400
_cell_length_b   8.26726249
_cell_length_c   8.39209638
_cell_angle_alpha   93.78981480
_cell_angle_beta   92.72274774
_cell_angle_gamma   103.07977218
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2P2(CO7)2
_chemical_formula_sum   'Li6 Fe4 P4 C4 O28'
_cell_volume   555.71653203
_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  0.26174900  0.00680100  0.89100000  1
  Li  Li1  1  0.76350600  0.50314500  0.89688900  1
  Li  Li2  1  0.89615600  0.86252100  0.71900700  1
  Li  Li3  1  0.10384400  0.13747900  0.28099300  1
  Li  Li4  1  0.23649400  0.49685500  0.10311100  1
  Li  Li5  1  0.73825100  0.99319900  0.10900000  1
  Fe  Fe6  1  0.02683200  0.28066700  0.67462800  1
  Fe  Fe7  1  0.52063700  0.77443100  0.66044400  1
  Fe  Fe8  1  0.97316800  0.71933300  0.32537200  1
  Fe  Fe9  1  0.47936300  0.22556900  0.33955600  1
  P  P10  1  0.23187600  0.99019900  0.57722900  1
  P  P11  1  0.74028100  0.49060400  0.57989700  1
  P  P12  1  0.76812400  0.00980100  0.42277100  1
  P  P13  1  0.25971900  0.50939600  0.42010300  1
  C  C14  1  0.98190800  0.21701100  0.96170000  1
  C  C15  1  0.48033300  0.72911100  0.95569200  1
  C  C16  1  0.01809200  0.78298900  0.03830000  1
  C  C17  1  0.51966700  0.27088900  0.04430800  1
  O  O18  1  0.09430800  0.34744300  0.92977100  1
  O  O19  1  0.60136600  0.85171200  0.92665400  1
  O  O20  1  0.04504200  0.82825200  0.89833400  1
  O  O21  1  0.89524800  0.13235400  0.83667700  1
  O  O22  1  0.56001800  0.31429400  0.90780000  1
  O  O23  1  0.39392500  0.64642000  0.82929100  1
  O  O24  1  0.17950600  0.11729200  0.69673200  1
  O  O25  1  0.36670500  0.92929100  0.67595000  1
  O  O26  1  0.86030300  0.42231800  0.69127100  1
  O  O27  1  0.69537700  0.63033700  0.69326100  1
  O  O28  1  0.07570000  0.84657900  0.52956900  1
  O  O29  1  0.70711200  0.93246500  0.57845200  1
  O  O30  1  0.18433800  0.44246500  0.57254600  1
  O  O31  1  0.58305100  0.35049600  0.53010400  1
  O  O32  1  0.92430000  0.15342100  0.47043100  1
  O  O33  1  0.29288800  0.06753500  0.42154800  1
  O  O34  1  0.81566200  0.55753500  0.42745400  1
  O  O35  1  0.41694900  0.64950400  0.46989600  1
  O  O36  1  0.82049400  0.88270800  0.30326800  1
  O  O37  1  0.13969700  0.57768200  0.30872900  1
  O  O38  1  0.63329500  0.07070900  0.32405000  1
  O  O39  1  0.30462300  0.36966300  0.30673900  1
  O  O40  1  0.10475200  0.86764600  0.16332300  1
  O  O41  1  0.95495800  0.17174800  0.10166600  1
  O  O42  1  0.60607500  0.35358000  0.17070900  1
  O  O43  1  0.43998200  0.68570600  0.09220000  1
  O  O44  1  0.39863400  0.14828800  0.07334600  1
  O  O45  1  0.90569200  0.65255700  0.07022900  1
