# generated using pymatgen
data_BaTi6O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.45469703
_cell_length_b   8.45473669
_cell_length_c   8.45468127
_cell_angle_alpha   106.06169275
_cell_angle_beta   106.06127101
_cell_angle_gamma   116.53033029
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaTi6O12
_chemical_formula_sum   'Ba2 Ti12 O24'
_cell_volume   459.87432132
_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
  Ba  Ba0  1  0.22044327  0.22044006  0.00000917  1.0
  Ba  Ba1  1  0.77956173  0.77955932  -0.00000505  1.0
  Ti  Ti2  1  0.31017901  0.82780474  0.81494750  1.0
  Ti  Ti3  1  0.65215327  0.16688175  0.81903366  1.0
  Ti  Ti4  1  0.68982825  0.17219507  0.18506577  1.0
  Ti  Ti5  1  0.49523286  0.31017559  0.48236057  1.0
  Ti  Ti6  1  0.83311370  0.65214397  0.48527038  1.0
  Ti  Ti7  1  0.17219548  0.98713719  0.48236980  1.0
  Ti  Ti8  1  0.50476749  0.68981277  0.51762470  1.0
  Ti  Ti9  1  0.16688457  0.34785365  0.51472507  1.0
  Ti  Ti10  1  0.82780657  0.01287526  0.51763756  1.0
  Ti  Ti11  1  0.98712251  0.50476199  0.81493118  1.0
  Ti  Ti12  1  0.34784660  0.83311647  0.18096768  1.0
  Ti  Ti13  1  0.01286668  0.49523883  0.18505804  1.0
  O  O14  1  0.80641115  0.84856853  0.65499334  1.0
  O  O15  1  0.50313296  0.87259195  0.71058708  1.0
  O  O16  1  0.83799122  0.20745625  0.71058805  1.0
  O  O17  1  0.82008573  0.46162245  0.95590541  1.0
  O  O18  1  0.49428041  0.13582631  0.95590385  1.0
  O  O19  1  0.53586149  0.83686580  0.37273334  1.0
  O  O20  1  0.46415403  0.16314935  0.62726920  1.0
  O  O21  1  0.79254097  0.50312869  0.63054474  1.0
  O  O22  1  0.50572464  0.86418038  0.04409625  1.0
  O  O23  1  0.49687809  0.12741622  0.28942057  1.0
  O  O24  1  0.13582899  0.17992888  0.64154657  1.0
  O  O25  1  0.46162750  0.50572170  0.64154445  1.0
  O  O26  1  0.19359513  0.15143926  0.34500634  1.0
  O  O27  1  0.53837421  0.49427661  0.35846540  1.0
  O  O28  1  0.16311921  0.53586132  0.69898154  1.0
  O  O29  1  0.15142591  0.80641556  0.95784204  1.0
  O  O30  1  0.20745851  0.49686469  0.36945548  1.0
  O  O31  1  0.87259574  0.16200890  0.36946442  1.0
  O  O32  1  0.12739838  0.83799207  0.63054204  1.0
  O  O33  1  0.84856253  0.19357471  0.04215762  1.0
  O  O34  1  0.17991488  0.53837045  0.04408367  1.0
  O  O35  1  0.83685617  0.46412460  0.30100528  1.0
  O  O36  1  0.16201239  0.79254493  0.28941241  1.0
  O  O37  1  0.86416776  0.82007573  0.35845591  1.0