data_[Re6As10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.8351]
_cell_length_b [8.1327]
_cell_length_c [19.2004]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.5988]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Re3As5]
_chemical_formula_sum '[Re6 As10]'
_cell_volume [911.1130]
_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
[
  Re  Re0  1  0.0080  0.9893  0.4859  1
  Re  Re1  1  0.1300  0.3449  0.5316  1
  Re  Re2  1  0.4377  0.8468  0.5310  1
  Re  Re3  1  0.5225  0.5325  0.4960  1
  Re  Re4  1  0.6389  0.1904  0.5092  1
  Re  Re5  1  0.9163  0.6924  0.5387  1
  As  As6  1  0.1725  0.7003  0.4343  1
  As  As7  1  0.2685  0.0973  0.5893  1
  As  As8  1  0.2696  0.5969  0.6054  1
  As  As9  1  0.3465  0.3298  0.4179  1
  As  As10  1  0.3768  0.0095  0.4157  1
  As  As11  1  0.6898  0.7681  0.4255  1
  As  As12  1  0.7557  0.4129  0.5983  1
  As  As13  1  0.7812  0.9532  0.6027  1
  As  As14  1  0.8190  0.1230  0.3867  1
  As  As15  1  0.8670  0.4127  0.4320  1
]