# generated using pymatgen
data_Li8Fe7Cu(PO4)12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.67144200
_cell_length_b   8.81127368
_cell_length_c   12.23813295
_cell_angle_alpha   89.99616733
_cell_angle_beta   89.95412829
_cell_angle_gamma   89.95530794
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Fe7Cu(PO4)12
_chemical_formula_sum   'Li8 Fe7 Cu1 P12 O48'
_cell_volume   935.07169075
_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  0.21656200  0.72211200  0.18178500  1
  Li  Li1  1  0.21654300  0.77787600  0.81849000  1
  Li  Li2  1  0.28337500  0.22200300  0.31842900  1
  Li  Li3  1  0.28376100  0.27802900  0.68141400  1
  Li  Li4  1  0.71569800  0.72180000  0.31871800  1
  Li  Li5  1  0.71640200  0.77636700  0.68185100  1
  Li  Li6  1  0.78404500  0.22197700  0.18182900  1
  Li  Li7  1  0.78437500  0.27784800  0.81638600  1
  Fe  Fe8  1  0.24923600  0.95924200  0.61350100  1
  Fe  Fe9  1  0.24927400  0.54066300  0.38687200  1
  Fe  Fe10  1  0.25038500  0.04122600  0.11289400  1
  Fe  Fe11  1  0.24997200  0.45868800  0.88674300  1
  Fe  Fe12  1  0.74985100  0.54122900  0.11239200  1
  Fe  Fe13  1  0.74955500  0.95917300  0.88675200  1
  Fe  Fe14  1  0.75071800  0.04046400  0.38665200  1
  Cu  Cu15  1  0.75323300  0.45865800  0.61024300  1
  P  P16  1  0.10615600  0.39295100  0.14683700  1
  P  P17  1  0.10605200  0.10647300  0.85283300  1
  P  P18  1  0.39509800  0.60533300  0.64668000  1
  P  P19  1  0.39362000  0.89309600  0.35311000  1
  P  P20  1  0.60583300  0.10758900  0.64613900  1
  P  P21  1  0.60713700  0.39244100  0.35330800  1
  P  P22  1  0.89446100  0.60739500  0.85181400  1
  P  P23  1  0.89397900  0.89278900  0.14674500  1
  P  P24  1  0.03820700  0.25111100  0.50001500  1
  P  P25  1  0.46032700  0.74993100  0.99991700  1
  P  P26  1  0.54005200  0.25013100  0.99990200  1
  P  P27  1  0.95936100  0.74852600  0.49926300  1
  O  O28  1  0.05611700  0.64111300  0.42930500  1
  O  O29  1  0.05664400  0.85596100  0.56998100  1
  O  O30  1  0.07267100  0.89534000  0.15513900  1
  O  O31  1  0.07312900  0.60476100  0.84341400  1
  O  O32  1  0.14847000  0.16328300  0.57824200  1
  O  O33  1  0.14797800  0.33795100  0.42119300  1
  O  O34  1  0.15681500  0.43362100  0.03056600  1
  O  O35  1  0.15755000  0.06610100  0.96905700  1
  O  O36  1  0.16312900  0.23281200  0.18006200  1
  O  O37  1  0.16353500  0.26660300  0.81983800  1
  O  O38  1  0.17372400  0.51329200  0.22639000  1
  O  O39  1  0.17323400  0.98596800  0.77311000  1
  O  O40  1  0.32654000  0.01362900  0.27365100  1
  O  O41  1  0.32735100  0.48552200  0.72625600  1
  O  O42  1  0.33798600  0.76623400  0.67972600  1
  O  O43  1  0.33621500  0.73291900  0.32031100  1
  O  O44  1  0.34401000  0.56524500  0.53059100  1
  O  O45  1  0.34173800  0.93347400  0.46955800  1
  O  O46  1  0.35112400  0.83749900  0.07855200  1
  O  O47  1  0.35106500  0.66239200  0.92151500  1
  O  O48  1  0.42689600  0.10427300  0.65483700  1
  O  O49  1  0.42791700  0.39503000  0.34421900  1
  O  O50  1  0.44308200  0.14302000  0.07039500  1
  O  O51  1  0.44255000  0.35728800  0.92995300  1
  O  O52  1  0.55734400  0.64282500  0.07035100  1
  O  O53  1  0.55724500  0.85716100  0.92954000  1
  O  O54  1  0.57374400  0.60747800  0.65705200  1
  O  O55  1  0.57220600  0.89549900  0.34515100  1
  O  O56  1  0.64927000  0.33753800  0.07850100  1
  O  O57  1  0.64910100  0.16281100  0.92117400  1
  O  O58  1  0.65692600  0.06821400  0.52999300  1
  O  O59  1  0.65028600  0.43934900  0.46993200  1
  O  O60  1  0.66459400  0.23276700  0.32015800  1
  O  O61  1  0.66170600  0.26809300  0.68103000  1
  O  O62  1  0.67334200  0.51300600  0.27299900  1
  O  O63  1  0.67313400  0.98736500  0.72590700  1
  O  O64  1  0.82669600  0.01306500  0.22634100  1
  O  O65  1  0.82351700  0.48508900  0.77537400  1
  O  O66  1  0.83681300  0.73243700  0.17972700  1
  O  O67  1  0.83739100  0.76771100  0.81941400  1
  O  O68  1  0.84312100  0.56532800  0.96811800  1
  O  O69  1  0.84282600  0.93317200  0.03053100  1
  O  O70  1  0.85303300  0.66325800  0.58195500  1
  O  O71  1  0.85069600  0.83684800  0.42116500  1
  O  O72  1  0.92745100  0.10406600  0.84485600  1
  O  O73  1  0.92740500  0.39607400  0.15550400  1
  O  O74  1  0.94078700  0.14491500  0.43016500  1
  O  O75  1  0.94863100  0.35747900  0.57768800  1
