# generated using pymatgen
data_Li3AlFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.19113664
_cell_length_b   10.19113664
_cell_length_c   10.19113664
_cell_angle_alpha   116.65272919
_cell_angle_beta   116.65272919
_cell_angle_gamma   95.90252813
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3AlFeO4
_chemical_formula_sum   'Li24 Al8 Fe8 O32'
_cell_volume   781.80743086
_cell_formula_units_Z   8
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  0.92931400  0.10611200  0.15599900  1
  Li  Li1  1  0.82068600  0.14388800  0.34400100  1
  Li  Li2  1  0.89388800  0.04988600  0.82320100  1
  Li  Li3  1  0.52331500  0.17931400  0.32320100  1
  Li  Li4  1  0.44190800  0.29236900  0.13257700  1
  Li  Li5  1  0.71544100  0.56458600  0.14042600  1
  Li  Li6  1  0.22668500  0.07068600  0.17679900  1
  Li  Li7  1  0.85611200  0.20011400  0.67679900  1
  Li  Li8  1  0.70763100  0.84020800  0.14953900  1
  Li  Li9  1  0.43541400  0.57584000  0.15085500  1
  Li  Li10  1  0.79988600  0.47668500  0.65599900  1
  Li  Li11  1  0.95011400  0.77331500  0.84400100  1
  Li  Li12  1  0.31458600  0.67416000  0.34914500  1
  Li  Li13  1  0.42498500  0.28455900  0.84914500  1
  Li  Li14  1  0.04236900  0.40979200  0.35046100  1
  Li  Li15  1  0.69066900  0.55809200  0.85046100  1
  Li  Li16  1  0.03455900  0.68541400  0.35957400  1
  Li  Li17  1  0.42416000  0.57501500  0.85957400  1
  Li  Li18  1  0.59020800  0.94066900  0.63257700  1
  Li  Li19  1  0.30809200  0.95763100  0.36742300  1
  Li  Li20  1  0.15979200  0.30933100  0.86742300  1
  Li  Li21  1  0.32584000  0.67498500  0.64042600  1
  Li  Li22  1  0.05933100  0.69190800  0.64953900  1
  Li  Li23  1  0.32501500  0.96544100  0.65085500  1
  Al  Al24  1  0.74899600  0.41402600  0.30156500  1
  Al  Al25  1  0.16402600  0.36246100  0.16503000  1
  Al  Al26  1  0.55256900  0.25100400  0.66503000  1
  Al  Al27  1  0.58597400  0.88753900  0.33497000  1
  Al  Al28  1  0.63753900  0.80256900  0.80156500  1
  Al  Al29  1  0.00100400  0.83597400  0.19843500  1
  Al  Al30  1  0.11246100  0.44743100  0.69843500  1
  Al  Al31  1  0.19743100  0.99899600  0.83497000  1
  Fe  Fe32  1  0.45032400  0.92533000  0.99852800  1
  Fe  Fe33  1  0.54820500  0.54967600  0.47500700  1
  Fe  Fe34  1  0.67533000  0.17680200  0.97500700  1
  Fe  Fe35  1  0.82319800  0.79820500  0.49852800  1
  Fe  Fe36  1  0.29967600  0.32467000  0.50147200  1
  Fe  Fe37  1  0.07467000  0.07319800  0.52499300  1
  Fe  Fe38  1  0.20179500  0.70032400  0.02499300  1
  Fe  Fe39  1  0.92680200  0.45179500  0.00147200  1
  O  O40  1  0.83170400  0.26774900  0.24272500  1
  O  O41  1  0.33898000  0.08170400  0.06395500  1
  O  O42  1  0.59807800  0.35485600  0.08132600  1
  O  O43  1  0.86469000  0.64127600  0.09294600  1
  O  O44  1  0.88531000  0.60872400  0.40705400  1
  O  O45  1  0.64800500  0.39324300  0.39947500  1
  O  O46  1  0.41102000  0.16829600  0.43604500  1
  O  O47  1  0.35872400  0.45167000  0.22341400  1
  O  O48  1  0.52174400  0.11469000  0.72341400  1
  O  O49  1  0.91829600  0.98225100  0.25727500  1
  O  O50  1  0.14324300  0.24376800  0.24523800  1
  O  O51  1  0.75147000  0.35199500  0.74523800  1
  O  O52  1  0.64514400  0.72647000  0.24322200  1
  O  O53  1  0.10485600  0.52353000  0.25677800  1
  O  O54  1  0.48324800  0.40192200  0.75677800  1
  O  O55  1  0.60675700  0.00623200  0.25476200  1
  O  O56  1  0.72497500  0.66102000  0.74272500  1
  O  O57  1  0.39127600  0.79833000  0.27658600  1
  O  O58  1  0.22825600  0.13531000  0.77658600  1
  O  O59  1  0.73225100  0.97497500  0.56395500  1
  O  O60  1  0.47647000  0.73324800  0.58132600  1
  O  O61  1  0.10199500  0.85675700  0.10052500  1
  O  O62  1  0.99376800  0.24853000  0.60052500  1
  O  O63  1  0.20167000  0.47825600  0.59294600  1
  O  O64  1  0.54833000  0.77174400  0.90705400  1
  O  O65  1  0.75623200  0.00147000  0.89947500  1
  O  O66  1  0.27353000  0.51675200  0.91867400  1
  O  O67  1  0.15192200  0.89514400  0.41867400  1
  O  O68  1  0.01774900  0.27502500  0.93604500  1
  O  O69  1  0.02502500  0.58898000  0.75727500  1
  O  O70  1  0.26675200  0.84807800  0.74322200  1
  O  O71  1  0.99853000  0.89800500  0.75476200  1
