# CIF generated by HEAS from Alexandria entry agm003578331
data_agm003578331
_cell_length_a     3.74089
_cell_length_b     10.62206
_cell_length_c     10.79940
_cell_angle_alpha  108.87099
_cell_angle_beta   90.00000
_cell_angle_gamma  90.00000
_cell_volume       406.05914
_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 0.75000 0.43935 0.83805 1.00000
  Sc2 Sc 0.25000 0.56065 0.16195 1.00000
  Sc3 Sc 0.75000 0.67619 0.49940 1.00000
  Sc4 Sc 0.25000 0.32381 0.50060 1.00000
  Sc5 Sc 0.75000 0.15807 0.08427 1.00000
  Sc6 Sc 0.25000 0.84193 0.91573 1.00000
  Pa1 Pa 0.75000 0.05090 0.70014 1.00000
  Pa2 Pa 0.25000 0.94910 0.29986 1.00000
  S1 S 0.75000 0.47873 0.61568 1.00000
  S2 S 0.25000 0.52127 0.38432 1.00000
  S3 S 0.75000 0.91761 0.09219 1.00000
  S4 S 0.25000 0.08239 0.90781 1.00000
  S5 S 0.75000 0.39113 0.05979 1.00000
  S6 S 0.25000 0.60887 0.94021 1.00000
  S7 S 0.75000 0.73440 0.26953 1.00000
  S8 S 0.25000 0.26560 0.73047 1.00000
  S9 S 0.75000 0.11973 0.46552 1.00000
  S10 S 0.25000 0.88027 0.53448 1.00000
  S11 S 0.75000 0.80244 0.74760 1.00000
  S12 S 0.25000 0.19756 0.25240 1.00000