data_[Mg2Re6S8O22]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Re  1.9000  1.3500  0.7125
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [8.4253]
_cell_length_b [8.6060]
_cell_length_c [11.6173]
_cell_angle_alpha [68.3253]
_cell_angle_beta [84.7079]
_cell_angle_gamma [76.1596]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [MgRe3S4O11]
_chemical_formula_sum '[Mg2 Re6 S8 O22]'
_cell_volume [760.0567]
_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
[
  Mg  Mg0  2  0.1702  0.3050  0.6415  1
  Re  Re1  2  0.2150  0.6469  0.0305  1
  Re  Re2  2  0.3920  0.3528  0.8829  1
  Re  Re3  2  0.4826  0.2564  0.1994  1
  S  S4  2  0.2481  0.3480  0.0712  1
  S  S5  2  0.2670  0.6494  0.8242  1
  S  S6  2  0.3784  0.5334  0.2129  1
  S  S7  2  0.4011  0.8332  0.9675  1
  O  O8  2  0.0118  0.9338  0.2398  1
  O  O9  2  0.0191  0.7462  0.0503  1
  O  O10  2  0.0304  0.5255  0.3479  1
  O  O11  2  0.0470  0.3504  0.4375  1
  O  O12  2  0.0487  0.7360  0.5792  1
  O  O13  2  0.1135  0.9936  0.2776  1
  O  O14  2  0.1445  0.0641  0.6933  1
  O  O15  2  0.3153  0.2663  0.7925  1
  O  O16  2  0.3327  0.4596  0.5348  1
  O  O17  2  0.4419  0.3413  0.5114  1
  O  O18  2  0.4685  0.0914  0.3342  1
]