# generated using pymatgen
data_Li2Fe3(MoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23321400
_cell_length_b   10.67281100
_cell_length_c   18.49976400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe3(MoO4)3
_chemical_formula_sum   'Li8 Fe12 Mo12 O48'
_cell_volume   1033.26924164
_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
  Li  Li0  1  0.37962900  0.25000000  0.12040700  1
  Li  Li1  1  0.62037100  0.75000000  0.87959300  1
  Li  Li2  1  0.12037100  0.75000000  0.62040700  1
  Li  Li3  1  0.87962900  0.25000000  0.37959300  1
  Li  Li4  1  0.23228700  0.25000000  0.23356000  1
  Li  Li5  1  0.76771300  0.75000000  0.76644000  1
  Li  Li6  1  0.26771300  0.75000000  0.73356000  1
  Li  Li7  1  0.73228700  0.25000000  0.26644000  1
  Fe  Fe8  1  0.23896900  0.06995800  0.02556500  1
  Fe  Fe9  1  0.76103100  0.93004200  0.97443500  1
  Fe  Fe10  1  0.26103100  0.93004200  0.52556500  1
  Fe  Fe11  1  0.76103100  0.56995800  0.97443500  1
  Fe  Fe12  1  0.73896900  0.06995800  0.47443500  1
  Fe  Fe13  1  0.23896900  0.43004200  0.02556500  1
  Fe  Fe14  1  0.73896900  0.43004200  0.47443500  1
  Fe  Fe15  1  0.26103100  0.56995800  0.52556500  1
  Fe  Fe16  1  0.39586700  0.25000000  0.74925200  1
  Fe  Fe17  1  0.60413300  0.75000000  0.25074800  1
  Fe  Fe18  1  0.10413300  0.75000000  0.24925200  1
  Fe  Fe19  1  0.89586700  0.25000000  0.75074800  1
  Mo  Mo20  1  0.28737500  0.02466600  0.34918500  1
  Mo  Mo21  1  0.71262500  0.97533400  0.65081500  1
  Mo  Mo22  1  0.21262500  0.97533400  0.84918500  1
  Mo  Mo23  1  0.71262500  0.52466600  0.65081500  1
  Mo  Mo24  1  0.78737500  0.02466600  0.15081500  1
  Mo  Mo25  1  0.28737500  0.47533400  0.34918500  1
  Mo  Mo26  1  0.78737500  0.47533400  0.15081500  1
  Mo  Mo27  1  0.21262500  0.52466600  0.84918500  1
  Mo  Mo28  1  0.18939000  0.25000000  0.55908200  1
  Mo  Mo29  1  0.81061000  0.75000000  0.44091800  1
  Mo  Mo30  1  0.31061000  0.75000000  0.05908200  1
  Mo  Mo31  1  0.68939000  0.25000000  0.94091800  1
  O  O32  1  0.35466200  0.61626700  0.29566000  1
  O  O33  1  0.64533800  0.38373300  0.70434000  1
  O  O34  1  0.14533800  0.38373300  0.79566000  1
  O  O35  1  0.64533800  0.11626700  0.70434000  1
  O  O36  1  0.85466200  0.61626700  0.20434000  1
  O  O37  1  0.35466200  0.88373300  0.29566000  1
  O  O38  1  0.85466200  0.88373300  0.20434000  1
  O  O39  1  0.14533800  0.11626700  0.79566000  1
  O  O40  1  0.07701400  0.52215500  0.42619200  1
  O  O41  1  0.92298600  0.47784500  0.57380800  1
  O  O42  1  0.42298600  0.47784500  0.92619200  1
  O  O43  1  0.92298600  0.02215500  0.57380800  1
  O  O44  1  0.57701400  0.52215500  0.07380800  1
  O  O45  1  0.07701400  0.97784500  0.42619200  1
  O  O46  1  0.57701400  0.97784500  0.07380800  1
  O  O47  1  0.42298600  0.02215500  0.92619200  1
  O  O48  1  0.14726900  0.25000000  0.65805800  1
  O  O49  1  0.85273100  0.75000000  0.34194200  1
  O  O50  1  0.35273100  0.75000000  0.15805800  1
  O  O51  1  0.64726900  0.25000000  0.84194200  1
  O  O52  1  0.07636800  0.13122100  0.30097300  1
  O  O53  1  0.92363200  0.86877900  0.69902700  1
  O  O54  1  0.42363200  0.86877900  0.80097300  1
  O  O55  1  0.92363200  0.63122100  0.69902700  1
  O  O56  1  0.57636800  0.13122100  0.19902700  1
  O  O57  1  0.07636800  0.36877900  0.30097300  1
  O  O58  1  0.57636800  0.36877900  0.19902700  1
  O  O59  1  0.42363200  0.63122100  0.80097300  1
  O  O60  1  0.93589500  0.25000000  0.48346900  1
  O  O61  1  0.06410500  0.75000000  0.51653100  1
  O  O62  1  0.56410500  0.75000000  0.98346900  1
  O  O63  1  0.43589500  0.25000000  0.01653100  1
  O  O64  1  0.07506500  0.11696500  0.12907300  1
  O  O65  1  0.92493500  0.88303500  0.87092700  1
  O  O66  1  0.42493500  0.88303500  0.62907300  1
  O  O67  1  0.92493500  0.61696500  0.87092700  1
  O  O68  1  0.57506500  0.11696500  0.37092700  1
  O  O69  1  0.07506500  0.38303500  0.12907300  1
  O  O70  1  0.57506500  0.38303500  0.37092700  1
  O  O71  1  0.42493500  0.61696500  0.62907300  1
  O  O72  1  0.08878800  0.61458100  0.03646000  1
  O  O73  1  0.91121200  0.38541900  0.96354000  1
  O  O74  1  0.41121200  0.38541900  0.53646000  1
  O  O75  1  0.91121200  0.11458100  0.96354000  1
  O  O76  1  0.58878800  0.61458100  0.46354000  1
  O  O77  1  0.08878800  0.88541900  0.03646000  1
  O  O78  1  0.58878800  0.88541900  0.46354000  1
  O  O79  1  0.41121200  0.11458100  0.53646000  1
