# CIF generated by HEAS from Alexandria entry agm005652969
data_agm005652969
_cell_length_a     3.95463
_cell_length_b     3.95463
_cell_length_c     32.01935
_cell_angle_alpha  90.00000
_cell_angle_beta   90.00000
_cell_angle_gamma  120.00000
_cell_volume       433.66543
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
  'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
  Th1 Th 1.00000 1.00000 0.26102 1.00000
  Th2 Th 0.00000 0.00000 0.73898 1.00000
  Th3 Th 0.66667 0.33333 0.00000 1.00000
  I1 I 0.66667 0.33333 0.33223 1.00000
  I2 I 0.66667 0.33333 0.81018 1.00000
  I3 I 0.66667 0.33333 0.18982 1.00000
  I4 I 0.66667 0.33333 0.66777 1.00000
  Br1 Br 1.00000 1.00000 0.93687 1.00000
  Br2 Br 0.00000 0.00000 0.06313 1.00000