# CIF generated by HEAS from Alexandria entry agm001252257 data_agm001252257 _cell_length_a 16.92794 _cell_length_b 16.92794 _cell_length_c 16.92794 _cell_angle_alpha 109.47122 _cell_angle_beta 109.47122 _cell_angle_gamma 109.47122 _cell_volume 3734.14097 _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 Hg1 Hg 0.75000 0.37500 0.12500 1.00000 Hg2 Hg 0.87500 0.75000 0.12500 1.00000 Hg3 Hg 0.37500 0.75000 0.62500 1.00000 Hg4 Hg 0.25000 0.12500 0.37500 1.00000 Hg5 Hg 0.87500 0.12500 0.25000 1.00000 Hg6 Hg 0.37500 0.62500 0.25000 1.00000 Hg7 Hg 0.62500 0.37500 0.75000 1.00000 Hg8 Hg 0.12500 0.87500 0.75000 1.00000 Hg9 Hg 0.75000 0.87500 0.62500 1.00000 Hg10 Hg 0.62500 0.25000 0.37500 1.00000 Hg11 Hg 0.12500 0.25000 0.87500 1.00000 Hg12 Hg 0.25000 0.62500 0.87500 1.00000 Pt1 Pt 0.12500 0.37500 0.25000 1.00000 Pt2 Pt 0.00000 0.50000 0.00000 1.00000 Pt3 Pt 0.00000 0.00000 0.00000 1.00000 Pt4 Pt 0.37500 0.25000 0.12500 1.00000 Pt5 Pt 0.50000 0.00000 0.50000 1.00000 Pt6 Pt 0.50000 0.50000 0.00000 1.00000 Pt7 Pt 0.12500 0.75000 0.37500 1.00000 Pt8 Pt 0.75000 0.12500 0.87500 1.00000 Pt9 Pt 0.75000 0.62500 0.37500 1.00000 Pt10 Pt 0.37500 0.12500 0.75000 1.00000 Pt11 Pt 0.62500 0.87500 0.25000 1.00000 Pt12 Pt 0.50000 0.50000 0.50000 1.00000 Pt13 Pt 0.50000 0.00000 0.00000 1.00000 Pt14 Pt 0.00000 0.00000 0.50000 1.00000 Pt15 Pt 0.25000 0.37500 0.62500 1.00000 Pt16 Pt 0.25000 0.87500 0.12500 1.00000 Pt17 Pt 0.00000 0.50000 0.50000 1.00000 Pt18 Pt 0.87500 0.25000 0.62500 1.00000 Pt19 Pt 0.62500 0.75000 0.87500 1.00000 Pt20 Pt 0.87500 0.62500 0.75000 1.00000 Ba1 Ba 0.70823 0.12060 0.03098 1.00000 Ba2 Ba 0.32275 0.53098 0.41038 1.00000 Ba3 Ba 0.96902 0.37940 0.29177 1.00000 Ba4 Ba 0.53098 0.20823 0.12060 1.00000 Ba5 Ba 0.58763 0.70823 0.67725 1.00000 Ba6 Ba 0.96902 0.58962 0.17725 1.00000 Ba7 Ba 0.32275 0.79177 0.41237 1.00000 Ba8 Ba 0.08962 0.91237 0.12060 1.00000 Ba9 Ba 0.58962 0.96902 0.67725 1.00000 Ba10 Ba 0.70823 0.58763 0.17725 1.00000 Ba11 Ba 0.79177 0.46902 0.37940 1.00000 Ba12 Ba 0.82275 0.91038 0.03098 1.00000 Ba13 Ba 0.12060 0.70823 0.53098 1.00000 Ba14 Ba 0.37940 0.41038 0.08763 1.00000 Ba15 Ba 0.08763 0.91038 0.37940 1.00000 Ba16 Ba 0.41237 0.12060 0.58962 1.00000 Ba17 Ba 0.08763 0.17725 0.20823 1.00000 Ba18 Ba 0.46902 0.67725 0.08962 1.00000 Ba19 Ba 0.82275 0.91237 0.29177 1.00000 Ba20 Ba 0.12060 0.41237 0.08962 1.00000 Ba21 Ba 0.37940 0.96902 0.79177 1.00000 Ba22 Ba 0.58962 0.62060 0.41237 1.00000 Ba23 Ba 0.91038 0.82275 0.53098 1.00000 Ba24 Ba 0.79177 0.32275 0.91237 1.00000 Ba25 Ba 0.41038 0.37940 0.58763 1.00000 Ba26 Ba 0.08962 0.17725 0.46902 1.00000 Ba27 Ba 0.20823 0.67725 0.08763 1.00000 Ba28 Ba 0.17725 0.08763 0.70823 1.00000 Ba29 Ba 0.62060 0.03098 0.20823 1.00000 Ba30 Ba 0.87940 0.58763 0.91038 1.00000 Ba31 Ba 0.53098 0.32275 0.91038 1.00000 Ba32 Ba 0.58763 0.87940 0.41038 1.00000 Ba33 Ba 0.91237 0.82275 0.79177 1.00000 Ba34 Ba 0.91237 0.08962 0.62060 1.00000 Ba35 Ba 0.87940 0.29177 0.46902 1.00000 Ba36 Ba 0.17725 0.08962 0.96902 1.00000 Ba37 Ba 0.62060 0.58962 0.91237 1.00000 Ba38 Ba 0.41038 0.03098 0.32275 1.00000 Ba39 Ba 0.29177 0.41237 0.82275 1.00000 Ba40 Ba 0.20823 0.53098 0.62060 1.00000 Ba41 Ba 0.91038 0.08763 0.87940 1.00000 Ba42 Ba 0.67725 0.20823 0.58763 1.00000 Ba43 Ba 0.46902 0.79177 0.87940 1.00000 Ba44 Ba 0.03098 0.41038 0.82275 1.00000 Ba45 Ba 0.41237 0.29177 0.32275 1.00000 Ba46 Ba 0.03098 0.62060 0.70823 1.00000 Ba47 Ba 0.67725 0.46902 0.58962 1.00000 Ba48 Ba 0.29177 0.87940 0.96902 1.00000