# generated using pymatgen
data_Ac5(C2Br)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.13667375
_cell_length_b   12.10499833
_cell_length_c   14.71667294
_cell_angle_alpha   80.27722109
_cell_angle_beta   81.92069216
_cell_angle_gamma   80.16180899
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ac5(C2Br)3
_chemical_formula_sum   'Ac10 C12 Br6'
_cell_volume   710.91398838
_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
  Ac  Ac0  1  0.49907356  0.89560713  0.10624475  1.0
  Ac  Ac1  1  0.50092644  0.10439287  0.89375525  1.0
  Ac  Ac2  1  0.49803876  0.60790867  0.39601380  1.0
  Ac  Ac3  1  0.50196124  0.39209133  0.60398620  1.0
  Ac  Ac4  1  0.83808443  0.67782645  0.64600269  1.0
  Ac  Ac5  1  0.16191557  0.32217355  0.35399731  1.0
  Ac  Ac6  1  0.16994526  0.54013325  0.11997523  1.0
  Ac  Ac7  1  0.83005474  0.45986675  0.88002477  1.0
  Ac  Ac8  1  0.83439097  0.22697172  0.10424735  1.0
  Ac  Ac9  1  0.16560903  0.77302828  0.89575265  1.0
  C  C10  1  0.96626652  0.53376195  0.53370601  1.0
  C  C11  1  0.03373348  0.46623805  0.46629399  1.0
  C  C12  1  0.63131918  0.70701119  0.03035044  1.0
  C  C13  1  0.36868082  0.29298881  0.96964956  1.0
  C  C14  1  0.69604287  0.39066958  0.21724468  1.0
  C  C15  1  0.30395713  0.60933042  0.78275532  1.0
  C  C16  1  0.30243630  0.37936499  0.01576441  1.0
  C  C17  1  0.69756370  0.62063501  0.98423559  1.0
  C  C18  1  0.96626402  0.04747841  0.01999254  1.0
  C  C19  1  0.03373598  0.95252159  0.98000746  1.0
  C  C20  1  0.62963515  0.47088456  0.26984715  1.0
  C  C21  1  0.37036485  0.52911544  0.73015285  1.0
  Br  Br22  1  0.66740293  0.17732872  0.48786542  1.0
  Br  Br23  1  0.33259707  0.82267128  0.51213458  1.0
  Br  Br24  1  0.33049018  0.08809102  0.25092862  1.0
  Br  Br25  1  0.66950982  0.91190898  0.74907138  1.0
  Br  Br26  1  0.98775322  0.76514139  0.25935418  1.0
  Br  Br27  1  0.01224678  0.23485861  0.74064582  1.0