# CIF generated by HEAS from Alexandria entry agm005756404
data_agm005756404
_cell_length_a     6.97206
_cell_length_b     6.97206
_cell_length_c     7.03704
_cell_angle_alpha  99.50286
_cell_angle_beta   99.50285
_cell_angle_gamma  120.06721
_cell_volume       279.40024
_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 0.60656 0.93989 0.77308 1.00000
  Th2 Th 0.06010 0.39344 0.22692 1.00000
  Th3 Th 0.90794 0.59079 0.77176 1.00000
  Th4 Th 0.25746 0.24127 0.77176 1.00000
  Th5 Th 0.40921 0.09206 0.22824 1.00000
  Th6 Th 0.75873 0.74254 0.22824 1.00000
  B1 B 0.99955 0.00045 1.00000 1.00000
  B2 B 0.66712 0.33288 0.00000 1.00000
  S1 S 0.83334 0.16666 0.50000 1.00000
  S2 S 0.33333 0.66666 0.00000 1.00000
  S3 S 0.17013 0.82986 0.50000 1.00000
  S4 S 0.49654 0.50346 0.50000 1.00000