# generated using pymatgen
data_TcSO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24133562
_cell_length_b   5.23972826
_cell_length_c   7.38859568
_cell_angle_alpha   108.53868711
_cell_angle_beta   108.98854395
_cell_angle_gamma   99.87477877
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcSO5
_chemical_formula_sum   'Tc2 S2 O10'
_cell_volume   173.14968914
_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
  Tc  Tc0  1  0.00000000  0.50000000  0.50000000  1.0
  Tc  Tc1  1  0.50000000  0.00000000  0.00000000  1.0
  S  S2  1  0.09281284  0.92459335  0.25201619  1.0
  S  S3  1  0.90718716  0.07540665  0.74798381  1.0
  O  O4  1  0.69515515  0.32555357  0.25680413  1.0
  O  O5  1  0.30484485  0.67444643  0.74319587  1.0
  O  O6  1  0.77945485  0.81558730  0.13464271  1.0
  O  O7  1  0.19657648  0.23593620  0.35234745  1.0
  O  O8  1  0.22054515  0.18441270  0.86535729  1.0
  O  O9  1  0.80342352  0.76406380  0.64765255  1.0
  O  O10  1  0.17394010  0.80136552  0.40518716  1.0
  O  O11  1  0.22051931  0.82970768  0.10066784  1.0
  O  O12  1  0.82605990  0.19863448  0.59481284  1.0
  O  O13  1  0.77948069  0.17029232  0.89933216  1.0