# generated using pymatgen
data_Li4TiMn2Ni3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.50646900
_cell_length_b   8.58803530
_cell_length_c   8.59847189
_cell_angle_alpha   61.75785907
_cell_angle_beta   62.09886416
_cell_angle_gamma   61.98712640
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4TiMn2Ni3(PO4)6
_chemical_formula_sum   'Li4 Ti1 Mn2 Ni3 P6 O24'
_cell_volume   463.52234548
_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  0.25211000  0.64685800  0.84820000  1
  Li  Li1  1  0.70802200  0.35006000  0.15034400  1
  Li  Li2  1  0.35177800  0.14838200  0.70840900  1
  Li  Li3  1  0.14868600  0.70605900  0.35171000  1
  Ti  Ti4  1  0.14792100  0.14903900  0.15462700  1
  Mn  Mn5  1  0.98321400  0.00287800  0.99775800  1
  Mn  Mn6  1  0.51213500  0.49927900  0.49500900  1
  Ni  Ni7  1  0.85567500  0.85330200  0.85101100  1
  Ni  Ni8  1  0.64374000  0.64789800  0.64385500  1
  Ni  Ni9  1  0.35523300  0.34999100  0.35345700  1
  P  P10  1  0.75452200  0.04204100  0.45525900  1
  P  P11  1  0.44722500  0.75238300  0.04090700  1
  P  P12  1  0.05062000  0.45677500  0.75555600  1
  P  P13  1  0.95344700  0.55256800  0.25522800  1
  P  P14  1  0.55247000  0.25161100  0.95411100  1
  P  P15  1  0.25257800  0.95346800  0.55423600  1
  O  O16  1  0.88235300  0.49624800  0.70954600  1
  O  O17  1  0.69846100  0.88818400  0.47782900  1
  O  O18  1  0.94931700  0.73344500  0.08635900  1
  O  O19  1  0.44903900  0.70104000  0.89204700  1
  O  O20  1  0.01188100  0.38207000  0.19131100  1
  O  O21  1  0.76195700  0.55812100  0.40587000  1
  O  O22  1  0.74065200  0.09654800  0.92499700  1
  O  O23  1  0.53231200  0.41634600  0.77273500  1
  O  O24  1  0.82532700  0.00694500  0.60283500  1
  O  O25  1  0.40164500  0.75845500  0.56168800  1
  O  O26  1  0.90772100  0.08078900  0.25076200  1
  O  O27  1  0.60875800  0.81331700  0.98904800  1
  O  O28  1  0.38327400  0.18099000  0.01896000  1
  O  O29  1  0.09927900  0.92599200  0.74672600  1
  O  O30  1  0.59632600  0.23965900  0.43350600  1
  O  O31  1  0.18467400  0.01130600  0.38776600  1
  O  O32  1  0.43487200  0.59273500  0.23651400  1
  O  O33  1  0.24691800  0.90860100  0.08507800  1
  O  O34  1  0.24472900  0.42815800  0.59513700  1
  O  O35  1  0.03992500  0.60249500  0.81642300  1
  O  O36  1  0.52977700  0.31193700  0.10651500  1
  O  O37  1  0.07871900  0.25417000  0.91167200  1
  O  O38  1  0.31730000  0.10461000  0.52690600  1
  O  O39  1  0.10541300  0.52224600  0.32309500  1
