# CIF generated by HEAS from Alexandria entry agm005000976
data_agm005000976
_cell_length_a     4.61632
_cell_length_b     9.17733
_cell_length_c     10.69040
_cell_angle_alpha  103.32166
_cell_angle_beta   90.00000
_cell_angle_gamma  90.00000
_cell_volume       440.71729
_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 0.25000 0.85184 0.83375 1.00000
  Ca2 Ca 0.75000 0.14816 0.16625 1.00000
  Tl1 Tl 0.25000 0.69372 0.42161 1.00000
  Tl2 Tl 0.75000 0.30628 0.57839 1.00000
  I1 I 0.75000 0.92688 0.65299 1.00000
  I2 I 0.75000 0.80179 0.02286 1.00000
  I3 I 0.25000 0.07312 0.34701 1.00000
  I4 I 0.25000 0.19821 0.97714 1.00000
  Br1 Br 0.25000 0.55286 0.68123 1.00000
  Br2 Br 0.75000 0.44714 0.31877 1.00000