# generated using pymatgen
data_Li4TiFe3Cu2(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.57580800
_cell_length_b   8.67570223
_cell_length_c   8.72801762
_cell_angle_alpha   61.26068290
_cell_angle_beta   61.57688898
_cell_angle_gamma   61.54831927
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4TiFe3Cu2(PO4)6
_chemical_formula_sum   'Li4 Ti1 Fe3 Cu2 P6 O24'
_cell_volume   474.24172602
_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  0.25425700  0.64741900  0.84668800  1
  Li  Li1  1  0.71562500  0.34249000  0.15683100  1
  Li  Li2  1  0.34371000  0.15515300  0.71600800  1
  Li  Li3  1  0.15597000  0.71593100  0.34433800  1
  Ti  Ti4  1  0.14786100  0.14763500  0.15297300  1
  Fe  Fe5  1  0.85416400  0.85908800  0.85468700  1
  Fe  Fe6  1  0.64590700  0.64244000  0.63749100  1
  Fe  Fe7  1  0.35085300  0.34783600  0.35136800  1
  Cu  Cu8  1  0.97579400  0.01348600  0.99893000  1
  Cu  Cu9  1  0.51879900  0.49522800  0.48598000  1
  P  P10  1  0.25290700  0.95307600  0.55275000  1
  P  P11  1  0.95126100  0.55261100  0.25422300  1
  P  P12  1  0.55402100  0.25216700  0.95381300  1
  P  P13  1  0.75642700  0.03631200  0.45905200  1
  P  P14  1  0.45196400  0.75331000  0.03536100  1
  P  P15  1  0.04231700  0.45974300  0.75878200  1
  O  O16  1  0.87045800  0.49983300  0.71606900  1
  O  O17  1  0.70228800  0.87772200  0.48800100  1
  O  O18  1  0.94330300  0.73048700  0.08247800  1
  O  O19  1  0.45914100  0.70646300  0.88152800  1
  O  O20  1  0.00863200  0.37810900  0.20045900  1
  O  O21  1  0.76023400  0.55993800  0.41103000  1
  O  O22  1  0.74033300  0.09267300  0.92262900  1
  O  O23  1  0.53852500  0.42118300  0.77451500  1
  O  O24  1  0.82553300  0.99419600  0.61047300  1
  O  O25  1  0.40741700  0.75948300  0.56405900  1
  O  O26  1  0.91632400  0.06674900  0.26353200  1
  O  O27  1  0.61826800  0.80956600  0.98168600  1
  O  O28  1  0.38121500  0.19061600  0.01388000  1
  O  O29  1  0.09527400  0.92301900  0.74151700  1
  O  O30  1  0.59576700  0.22764300  0.44035700  1
  O  O31  1  0.19446200  0.00799100  0.38345600  1
  O  O32  1  0.43935800  0.59196300  0.22462800  1
  O  O33  1  0.26027200  0.91665100  0.07306000  1
  O  O34  1  0.23013900  0.43229900  0.59750300  1
  O  O35  1  0.02482600  0.61122300  0.81542400  1
  O  O36  1  0.53665500  0.30529400  0.10632900  1
  O  O37  1  0.06463300  0.26540800  0.92227500  1
  O  O38  1  0.31288000  0.10283100  0.53277100  1
  O  O39  1  0.10223000  0.53173500  0.31606800  1
