# CIF generated by HEAS from Alexandria entry agm005671114
data_agm005671114
_cell_length_a     4.00444
_cell_length_b     8.22760
_cell_length_c     8.78517
_cell_angle_alpha  116.54819
_cell_angle_beta   93.19532
_cell_angle_gamma  91.89851
_cell_volume       257.97589
_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 0.00000 0.00000 0.00000 1.00000
  S1 S 0.89484 0.50004 0.27295 1.00000
  S2 S 0.10516 0.49996 0.72705 1.00000
  S3 S 0.87709 0.71461 0.70753 1.00000
  S4 S 0.89327 0.27500 0.53214 1.00000
  S5 S 0.10673 0.72500 0.46786 1.00000
  S6 S 0.12291 0.28539 0.29247 1.00000
  Br1 Br 0.49449 0.86247 0.11567 1.00000
  Br2 Br 0.50551 0.13753 0.88433 1.00000