# CIF generated by HEAS from Alexandria entry agm003332002
data_agm003332002
_cell_length_a     5.53860
_cell_length_b     5.75558
_cell_length_c     8.06810
_cell_angle_alpha  110.28397
_cell_angle_beta   110.07445
_cell_angle_gamma  90.00000
_cell_volume       224.51183
_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
  Ca1 Ca 0.75264 0.75178 0.50529 1.00000
  Ca2 Ca 0.24736 0.24822 0.49471 1.00000
  Tl1 Tl 0.38231 0.88437 0.76462 1.00000
  Tl2 Tl 0.50000 0.50000 0.00000 1.00000
  Tl3 Tl 0.61769 0.11563 0.23538 1.00000
  Hg1 Hg 0.86932 0.37007 0.73864 1.00000
  Hg2 Hg 0.13068 0.62993 0.26136 1.00000
  Hg3 Hg 0.00000 0.00000 0.00000 1.00000