# generated using pymatgen
data_Li4Ti3Mn3(NiO8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85318547
_cell_length_b   5.85318547
_cell_length_c   9.64504481
_cell_angle_alpha   89.87467311
_cell_angle_beta   89.87467311
_cell_angle_gamma   60.13835968
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti3Mn3(NiO8)2
_chemical_formula_sum   'Li4 Ti3 Mn3 Ni2 O16'
_cell_volume   286.56416043
_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  0.66920800  0.66920800  0.88531700  1
  Li  Li1  1  0.99606500  0.99606500  0.99776500  1
  Li  Li2  1  0.99632300  0.99632300  0.49959500  1
  Li  Li3  1  0.33605600  0.33605600  0.38773800  1
  Ti  Ti4  1  0.83167600  0.33798900  0.21483300  1
  Ti  Ti5  1  0.33798900  0.83167600  0.21483300  1
  Ti  Ti6  1  0.16978100  0.16978100  0.71400500  1
  Mn  Mn7  1  0.83072200  0.83072200  0.21516600  1
  Mn  Mn8  1  0.66266300  0.16856200  0.71514100  1
  Mn  Mn9  1  0.16856200  0.66266300  0.71514100  1
  Ni  Ni10  1  0.66637900  0.66637900  0.49028900  1
  Ni  Ni11  1  0.33350000  0.33350000  0.98763600  1
  O  O12  1  0.83977700  0.31810300  0.60704500  1
  O  O13  1  0.51850500  0.51850500  0.33124500  1
  O  O14  1  0.66881200  0.66881200  0.10390900  1
  O  O15  1  0.99586200  0.99586200  0.31426400  1
  O  O16  1  0.99590700  0.99590700  0.81235600  1
  O  O17  1  0.31810300  0.83977700  0.60704500  1
  O  O18  1  0.96475100  0.52069100  0.33280800  1
  O  O19  1  0.52069100  0.96475100  0.33280800  1
  O  O20  1  0.15987600  0.15987600  0.10577700  1
  O  O21  1  0.84042600  0.84042600  0.60915900  1
  O  O22  1  0.48477300  0.03613600  0.83123100  1
  O  O23  1  0.03613600  0.48477300  0.83123100  1
  O  O24  1  0.33717200  0.33717200  0.60605500  1
  O  O25  1  0.68097400  0.15728100  0.10769800  1
  O  O26  1  0.48207800  0.48207800  0.82999000  1
  O  O27  1  0.15728100  0.68097400  0.10769800  1
