# generated using pymatgen
data_Ba5Tc2Br2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.89677332
_cell_length_b   5.89677341
_cell_length_c   25.75700006
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000493
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba5Tc2Br2O9
_chemical_formula_sum   'Ba10 Tc4 Br4 O18'
_cell_volume   775.63029179
_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  0.33333300  0.66666700  0.91259509  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.41259509  1.0
  Ba  Ba2  1  0.66666700  0.33333300  0.08740491  1.0
  Ba  Ba3  1  0.33333300  0.66666700  0.17313895  1.0
  Ba  Ba4  1  0.66666700  0.33333300  0.67313895  1.0
  Ba  Ba5  1  0.33333300  0.66666700  0.32686105  1.0
  Ba  Ba6  1  0.66666700  0.33333300  0.82686105  1.0
  Ba  Ba7  1  0.66666700  0.33333300  0.25000000  1.0
  Ba  Ba8  1  0.33333300  0.66666700  0.58740491  1.0
  Ba  Ba9  1  0.33333300  0.66666700  0.75000000  1.0
  Tc  Tc10  1  0.00000000  0.00000000  0.80364126  1.0
  Tc  Tc11  1  0.00000000  0.00000000  0.30364126  1.0
  Tc  Tc12  1  0.00000000  0.00000000  0.69635874  1.0
  Tc  Tc13  1  0.00000000  0.00000000  0.19635874  1.0
  Br  Br14  1  0.33333300  0.66666700  0.45444989  1.0
  Br  Br15  1  0.33333300  0.66666700  0.04555011  1.0
  Br  Br16  1  0.66666700  0.33333300  0.54555011  1.0
  Br  Br17  1  0.66666700  0.33333300  0.95444989  1.0
  O  O18  1  0.15845226  0.84154774  0.65952786  1.0
  O  O19  1  0.68309748  0.84154774  0.84047214  1.0
  O  O20  1  0.15845226  0.31690252  0.65952786  1.0
  O  O21  1  0.84773153  0.15226847  0.75000000  1.0
  O  O22  1  0.30453595  0.15226847  0.75000000  1.0
  O  O23  1  0.15226847  0.30453595  0.25000000  1.0
  O  O24  1  0.15226847  0.84773153  0.25000000  1.0
  O  O25  1  0.69546405  0.84773153  0.25000000  1.0
  O  O26  1  0.84154774  0.15845226  0.34047214  1.0
  O  O27  1  0.31690252  0.15845226  0.15952786  1.0
  O  O28  1  0.84773153  0.69546405  0.75000000  1.0
  O  O29  1  0.84154774  0.68309748  0.15952786  1.0
  O  O30  1  0.31690252  0.15845226  0.34047214  1.0
  O  O31  1  0.84154774  0.15845226  0.15952786  1.0
  O  O32  1  0.15845226  0.31690252  0.84047214  1.0
  O  O33  1  0.84154774  0.68309748  0.34047214  1.0
  O  O34  1  0.68309748  0.84154774  0.65952786  1.0
  O  O35  1  0.15845226  0.84154774  0.84047214  1.0