# CIF generated by HEAS from Alexandria entry agm005692033 data_agm005692033 _cell_length_a 6.11000 _cell_length_b 8.26422 _cell_length_c 17.02342 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 859.58779 _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 Ba1 Ba 0.46679 0.25000 0.13857 1.00000 Ba2 Ba 0.96679 0.75000 0.36143 1.00000 Ba3 Ba 0.53321 0.75000 0.86143 1.00000 Ba4 Ba 0.03322 0.25000 0.63857 1.00000 Ba5 Ba 0.74436 0.25000 0.39595 1.00000 Ba6 Ba 0.24436 0.75000 0.10405 1.00000 Ba7 Ba 0.25564 0.75000 0.60405 1.00000 Ba8 Ba 0.75564 0.25000 0.89595 1.00000 Hg1 Hg 0.95390 0.05273 0.21215 1.00000 Hg2 Hg 0.45390 0.94727 0.28785 1.00000 Hg3 Hg 0.04610 0.55273 0.78785 1.00000 Hg4 Hg 0.54610 0.44727 0.71215 1.00000 Hg5 Hg 0.04610 0.94727 0.78785 1.00000 Hg6 Hg 0.54610 0.05273 0.71215 1.00000 Hg7 Hg 0.95390 0.44727 0.21215 1.00000 Hg8 Hg 0.45390 0.55273 0.28785 1.00000 Hg9 Hg 0.75398 0.55767 0.03887 1.00000 Hg10 Hg 0.25398 0.44233 0.46113 1.00000 Hg11 Hg 0.24602 0.05767 0.96113 1.00000 Hg12 Hg 0.74602 0.94233 0.53887 1.00000 Hg13 Hg 0.24602 0.44233 0.96113 1.00000 Hg14 Hg 0.74602 0.55767 0.53887 1.00000 Hg15 Hg 0.75398 0.94233 0.03887 1.00000 Hg16 Hg 0.25398 0.05767 0.46113 1.00000 Pd1 Pd 0.22379 0.25000 0.31326 1.00000 Pd2 Pd 0.72379 0.75000 0.18674 1.00000 Pd3 Pd 0.77621 0.75000 0.68674 1.00000 Pd4 Pd 0.27621 0.25000 0.81326 1.00000 Pd5 Pd 0.98236 0.25000 0.07090 1.00000 Pd6 Pd 0.48236 0.75000 0.42910 1.00000 Pd7 Pd 0.01764 0.75000 0.92910 1.00000 Pd8 Pd 0.51764 0.25000 0.57090 1.00000