# generated using pymatgen
data_LiTiMnO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.95893076
_cell_length_b   10.18742612
_cell_length_c   5.95892827
_cell_angle_alpha   104.65333096
_cell_angle_beta   117.60087538
_cell_angle_gamma   75.34676151
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiMnO4
_chemical_formula_sum   'Li4 Ti4 Mn4 O16'
_cell_volume   306.23583806
_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  0.31246600  0.06236000  0.18754500  1
  Li  Li1  1  0.81246700  0.56235100  0.68754300  1
  Li  Li2  1  0.18754600  0.43763900  0.31246500  1
  Li  Li3  1  0.68754200  0.93764800  0.81246700  1
  Ti  Ti4  1  0.75000100  0.25000000  0.75000200  1
  Ti  Ti5  1  0.25000000  0.74999900  0.25000300  1
  Ti  Ti6  1  0.00000000  0.00000400  0.50000100  1
  Ti  Ti7  1  0.50000200  0.49999800  0.99999800  1
  Mn  Mn8  1  0.24996600  0.75001500  0.74997900  1
  Mn  Mn9  1  0.75000200  0.74998600  0.24999200  1
  Mn  Mn10  1  0.74998800  0.24999000  0.24997500  1
  Mn  Mn11  1  0.24996900  0.25001000  0.74999000  1
  O  O12  1  0.66331400  0.13170100  0.39992500  1
  O  O13  1  0.16332400  0.63170400  0.89991800  1
  O  O14  1  0.10007900  0.13170400  0.83669500  1
  O  O15  1  0.60009000  0.63170200  0.33668000  1
  O  O16  1  0.39992600  0.36829900  0.66331200  1
  O  O17  1  0.89992000  0.86829500  0.16332500  1
  O  O18  1  0.83669400  0.36829700  0.10007900  1
  O  O19  1  0.33667900  0.86829900  0.60008900  1
  O  O20  1  0.87422700  0.35965700  0.62577800  1
  O  O21  1  0.37422200  0.85966400  0.12578800  1
  O  O22  1  0.10901700  0.12522600  0.39099300  1
  O  O23  1  0.60901900  0.62520900  0.89098200  1
  O  O24  1  0.62577900  0.14034200  0.87422500  1
  O  O25  1  0.12578600  0.64033700  0.37422100  1
  O  O26  1  0.39099200  0.37477300  0.10901200  1
  O  O27  1  0.89098200  0.87479100  0.60902000  1
