# generated using pymatgen
data_Ba4Fe3TcO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64700719
_cell_length_b   5.64700719
_cell_length_c   8.11499037
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4Fe3TcO12
_chemical_formula_sum   'Ba4 Fe3 Tc1 O12'
_cell_volume   258.77641404
_cell_formula_units_Z   1
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  0.50000000  0.00000000  0.74209072  1.0
  Ba  Ba1  1  0.00000000  0.50000000  0.25790928  1.0
  Ba  Ba2  1  0.50000000  0.00000000  0.25790928  1.0
  Ba  Ba3  1  0.00000000  0.50000000  0.74209072  1.0
  Fe  Fe4  1  0.50000000  0.50000000  0.50000000  1.0
  Fe  Fe5  1  0.00000000  0.00000000  0.50000000  1.0
  Fe  Fe6  1  0.50000000  0.50000000  0.00000000  1.0
  Tc  Tc7  1  0.00000000  0.00000000  0.00000000  1.0
  O  O8  1  0.00000000  0.00000000  0.76855148  1.0
  O  O9  1  0.50000000  0.50000000  0.25249325  1.0
  O  O10  1  0.76083198  0.76083198  0.50000000  1.0
  O  O11  1  0.24113051  0.24113051  0.00000000  1.0
  O  O12  1  0.76083198  0.23916802  0.50000000  1.0
  O  O13  1  0.24113051  0.75886949  0.00000000  1.0
  O  O14  1  0.00000000  0.00000000  0.23144852  1.0
  O  O15  1  0.50000000  0.50000000  0.74750675  1.0
  O  O16  1  0.23916802  0.23916802  0.50000000  1.0
  O  O17  1  0.75886949  0.75886949  0.00000000  1.0
  O  O18  1  0.23916802  0.76083198  0.50000000  1.0
  O  O19  1  0.75886949  0.24113051  0.00000000  1.0