# generated using pymatgen
data_Ba3TiMo2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81844992
_cell_length_b   5.81844949
_cell_length_c   14.15907043
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999711
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3TiMo2O9
_chemical_formula_sum   'Ba6 Ti2 Mo4 O18'
_cell_volume   415.12601979
_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  0.66666700  0.33333300  0.40272945  1.0
  Ba  Ba1  1  0.33333300  0.66666700  0.59727055  1.0
  Ba  Ba2  1  0.33333300  0.66666700  0.90257814  1.0
  Ba  Ba3  1  0.66666700  0.33333300  0.09742186  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.25237523  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.74762477  1.0
  Ti  Ti6  1  0.66666700  0.33333300  0.64947153  1.0
  Ti  Ti7  1  0.33333300  0.66666700  0.35052847  1.0
  Mo  Mo8  1  0.33333300  0.66666700  0.15414017  1.0
  Mo  Mo9  1  0.66666700  0.33333300  0.84585983  1.0
  Mo  Mo10  1  0.00000000  0.00000000  0.50000000  1.0
  Mo  Mo11  1  0.00000000  0.00000000  0.00000000  1.0
  O  O12  1  0.66066559  0.83033279  0.41654362  1.0
  O  O13  1  0.16966721  0.83033279  0.41654362  1.0
  O  O14  1  0.16966721  0.33933441  0.41654362  1.0
  O  O15  1  0.33933441  0.16966721  0.58345638  1.0
  O  O16  1  0.83033279  0.16966721  0.58345638  1.0
  O  O17  1  0.83033279  0.66066559  0.58345638  1.0
  O  O18  1  0.33984405  0.16992253  0.91912706  1.0
  O  O19  1  0.83007747  0.16992253  0.91912706  1.0
  O  O20  1  0.83007747  0.66015595  0.91912706  1.0
  O  O21  1  0.66015595  0.83007747  0.08087294  1.0
  O  O22  1  0.16992253  0.83007747  0.08087294  1.0
  O  O23  1  0.16992253  0.33984405  0.08087294  1.0
  O  O24  1  0.03376746  0.51688473  0.24771245  1.0
  O  O25  1  0.48311527  0.51688473  0.24771245  1.0
  O  O26  1  0.48311527  0.96623254  0.24771245  1.0
  O  O27  1  0.96623254  0.48311527  0.75228755  1.0
  O  O28  1  0.51688473  0.48311527  0.75228755  1.0
  O  O29  1  0.51688473  0.03376746  0.75228755  1.0