# CIF generated by HEAS from Alexandria entry agm005652940
data_agm005652940
_cell_length_a     3.79406
_cell_length_b     3.79406
_cell_length_c     23.18747
_cell_angle_alpha  90.00000
_cell_angle_beta   90.00000
_cell_angle_gamma  120.00001
_cell_volume       289.06234
_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
  Sc1 Sc 1.00000 1.00000 0.33305 1.00000
  Sc2 Sc 0.00000 0.00000 0.66695 1.00000
  Sc3 Sc 0.66667 0.33333 0.00000 1.00000
  I1 I 0.00000 0.00000 0.91589 1.00000
  I2 I 1.00000 1.00000 0.08411 1.00000
  Br1 Br 0.66667 0.33333 0.40755 1.00000
  Br2 Br 0.66667 0.33333 0.74153 1.00000
  Br3 Br 0.66667 0.33333 0.25847 1.00000
  Br4 Br 0.66667 0.33333 0.59245 1.00000