# generated using pymatgen
data_Li3Fe2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.79904200
_cell_length_b   8.47191400
_cell_length_c   12.30617389
_cell_angle_alpha   87.53286288
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2(PO4)3
_chemical_formula_sum   'Li12 Fe8 P12 O48'
_cell_volume   916.51005085
_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  0.19166800  0.70907900  0.95291100  1
  Li  Li1  1  0.80833200  0.29092100  0.04708900  1
  Li  Li2  1  0.40274000  0.50000000  0.25000000  1
  Li  Li3  1  0.09732400  0.00000000  0.25000000  1
  Li  Li4  1  0.80833200  0.70907900  0.45291100  1
  Li  Li5  1  0.59726000  0.50000000  0.75000000  1
  Li  Li6  1  0.19166800  0.29092100  0.54708900  1
  Li  Li7  1  0.50000000  0.50000000  0.00000000  1
  Li  Li8  1  0.00000000  0.00000000  0.50000000  1
  Li  Li9  1  0.90267600  0.00000000  0.75000000  1
  Li  Li10  1  0.00000000  0.00000000  0.00000000  1
  Li  Li11  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe12  1  0.99495300  0.28705800  0.35721100  1
  Fe  Fe13  1  0.00504700  0.71294200  0.64278900  1
  Fe  Fe14  1  0.99495300  0.71294200  0.14278900  1
  Fe  Fe15  1  0.00504700  0.28705800  0.85721100  1
  Fe  Fe16  1  0.49962900  0.78978700  0.35507900  1
  Fe  Fe17  1  0.50037100  0.21021300  0.64492100  1
  Fe  Fe18  1  0.49962900  0.21021300  0.14492100  1
  Fe  Fe19  1  0.50037100  0.78978700  0.85507900  1
  P  P20  1  0.29361400  0.50000000  0.75000000  1
  P  P21  1  0.70638600  0.50000000  0.25000000  1
  P  P22  1  0.14761200  0.64941100  0.39756900  1
  P  P23  1  0.79804600  0.00000000  0.25000000  1
  P  P24  1  0.64340300  0.15640700  0.89489300  1
  P  P25  1  0.64340300  0.84359300  0.60510700  1
  P  P26  1  0.14761200  0.35058900  0.10243100  1
  P  P27  1  0.85238800  0.35058900  0.60243100  1
  P  P28  1  0.20195400  0.00000000  0.75000000  1
  P  P29  1  0.35659700  0.15640700  0.39489300  1
  P  P30  1  0.85238800  0.64941100  0.89756900  1
  P  P31  1  0.35659700  0.84359300  0.10510700  1
  O  O32  1  0.06090100  0.24976500  0.01900500  1
  O  O33  1  0.89492200  0.47234200  0.91121000  1
  O  O34  1  0.90234900  0.27703600  0.71391300  1
  O  O35  1  0.39986800  0.57019900  0.83743900  1
  O  O36  1  0.70316600  0.87064300  0.30888400  1
  O  O37  1  0.82011000  0.14012300  0.90908900  1
  O  O38  1  0.58972000  0.74476400  0.50826000  1
  O  O39  1  0.90794300  0.06553500  0.33775400  1
  O  O40  1  0.06090100  0.75023500  0.48099500  1
  O  O41  1  0.41972500  0.01086500  0.10631500  1
  O  O42  1  0.41028000  0.74476400  0.00826000  1
  O  O43  1  0.17989000  0.85987700  0.09091100  1
  O  O44  1  0.82011000  0.85987700  0.59091100  1
  O  O45  1  0.80625800  0.37976300  0.31228000  1
  O  O46  1  0.70316600  0.12935700  0.19111600  1
  O  O47  1  0.59705300  0.74937100  0.71018600  1
  O  O48  1  0.39986800  0.42980100  0.66256100  1
  O  O49  1  0.59705300  0.25062900  0.78981400  1
  O  O50  1  0.41972500  0.98913500  0.39368500  1
  O  O51  1  0.32288700  0.34836900  0.08809800  1
  O  O52  1  0.09765100  0.27703600  0.21391300  1
  O  O53  1  0.58027500  0.01086500  0.60631500  1
  O  O54  1  0.60013200  0.57019900  0.33743900  1
  O  O55  1  0.29683400  0.12935700  0.69111600  1
  O  O56  1  0.19374200  0.37976300  0.81228000  1
  O  O57  1  0.10507800  0.52765800  0.08879000  1
  O  O58  1  0.58972000  0.25523600  0.99174000  1
  O  O59  1  0.93909900  0.75023500  0.98099500  1
  O  O60  1  0.09765100  0.72296400  0.28608700  1
  O  O61  1  0.41028000  0.25523600  0.49174000  1
  O  O62  1  0.09205700  0.06553500  0.83775400  1
  O  O63  1  0.17989000  0.14012300  0.40908900  1
  O  O64  1  0.67711300  0.34836900  0.58809800  1
  O  O65  1  0.40294700  0.74937100  0.21018600  1
  O  O66  1  0.40294700  0.25062900  0.28981400  1
  O  O67  1  0.09205700  0.93446500  0.66224600  1
  O  O68  1  0.58027500  0.98913500  0.89368500  1
  O  O69  1  0.60013200  0.42980100  0.16256100  1
  O  O70  1  0.32288700  0.65163100  0.41190200  1
  O  O71  1  0.90234900  0.72296400  0.78608700  1
  O  O72  1  0.80625800  0.62023700  0.18772000  1
  O  O73  1  0.10507800  0.47234200  0.41121000  1
  O  O74  1  0.93909900  0.24976500  0.51900500  1
  O  O75  1  0.19374200  0.62023700  0.68772000  1
  O  O76  1  0.29683400  0.87064300  0.80888400  1
  O  O77  1  0.67711300  0.65163100  0.91190200  1
  O  O78  1  0.89492200  0.52765800  0.58879000  1
  O  O79  1  0.90794300  0.93446500  0.16224600  1
