# CIF generated by HEAS from Alexandria entry agm006322331
data_agm006322331
_cell_length_a     5.82538
_cell_length_b     5.81790
_cell_length_c     9.06781
_cell_angle_alpha  87.51899
_cell_angle_beta   71.81465
_cell_angle_gamma  120.14737
_cell_volume       244.88047
_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 0.38233 0.68813 0.93115 1.00000
  Ca2 Ca 0.61963 0.29602 0.06930 1.00000
  Al1 Al 0.00029 0.99268 0.00051 1.00000
  H1 H 0.71840 0.00497 0.57973 1.00000
  H2 H 0.45855 0.72277 0.58041 1.00000
  H3 H 0.50394 0.76835 0.22722 1.00000
  H4 H 0.95688 0.68123 0.23080 1.00000
  H5 H 0.05266 0.23508 0.22759 1.00000
  H6 H 0.94432 0.75386 0.77094 1.00000
  H7 H 0.03426 0.29955 0.77194 1.00000
  H8 H 0.49063 0.21376 0.77277 1.00000
  H9 H 0.30912 0.24657 0.42006 1.00000
  H10 H 0.28380 0.96426 0.41746 1.00000
  Br1 Br 0.07476 0.48255 0.49705 1.00000
  O1 O 0.59353 0.80876 0.63424 1.00000
  O2 O 0.61180 0.88913 0.11994 1.00000
  O3 O 0.96937 0.68958 0.12107 1.00000
  O4 O 0.17042 0.24992 0.12002 1.00000
  O5 O 0.83132 0.73552 0.88049 1.00000
  O6 O 0.03168 0.29529 0.88012 1.00000
  O7 O 0.38992 0.09668 0.88040 1.00000
  O8 O 0.41225 0.16197 0.36687 1.00000