# generated using pymatgen
data_MgTi4O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16166895
_cell_length_b   5.16166895
_cell_length_c   14.96203300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   146.87453573
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTi4O6
_chemical_formula_sum   'Mg2 Ti8 O12'
_cell_volume   217.84148095
_cell_formula_units_Z   2
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
  Mg  Mg0  1  0.34199600  0.65800400  0.75000000  1.0
  Mg  Mg1  1  0.65800400  0.34199600  0.25000000  1.0
  Ti  Ti2  1  0.14650900  0.85349100  0.03968600  1.0
  Ti  Ti3  1  0.59770400  0.40229600  0.63023800  1.0
  Ti  Ti4  1  0.85349100  0.14650900  0.96031400  1.0
  Ti  Ti5  1  0.40229600  0.59770400  0.36976200  1.0
  Ti  Ti6  1  0.14650900  0.85349100  0.46031400  1.0
  Ti  Ti7  1  0.85349100  0.14650900  0.53968600  1.0
  Ti  Ti8  1  0.40229600  0.59770400  0.13023800  1.0
  Ti  Ti9  1  0.59770400  0.40229600  0.86976200  1.0
  O  O10  1  0.50000000  0.50000000  0.50000000  1.0
  O  O11  1  0.50000000  0.50000000  0.00000000  1.0
  O  O12  1  0.95571300  0.04428700  0.83805700  1.0
  O  O13  1  0.04428700  0.95571300  0.16194300  1.0
  O  O14  1  0.04428700  0.95571300  0.33805700  1.0
  O  O15  1  0.95571300  0.04428700  0.66194300  1.0
  O  O16  1  0.23514800  0.76485200  0.90425800  1.0
  O  O17  1  0.76485200  0.23514800  0.09574200  1.0
  O  O18  1  0.76485200  0.23514800  0.40425800  1.0
  O  O19  1  0.23514800  0.76485200  0.59574200  1.0
  O  O20  1  0.68922600  0.31077400  0.75000000  1.0
  O  O21  1  0.31077400  0.68922600  0.25000000  1.0