# CIF generated by HEAS from Alexandria entry agm017385859 data_agm017385859 _cell_length_a 7.06209 _cell_length_b 7.17317 _cell_length_c 10.04787 _cell_angle_alpha 87.60398 _cell_angle_beta 73.21511 _cell_angle_gamma 84.58635 _cell_volume 485.08450 _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 0.00000 0.50000 0.00000 1.00000 Ca2 Ca 0.55377 0.79151 0.23305 1.00000 Ca3 Ca 0.44623 0.20849 0.76695 1.00000 Ca4 Ca 0.21395 0.17414 0.47811 1.00000 Ca5 Ca 0.78605 0.82586 0.52189 1.00000 Ca6 Ca 0.92473 0.01727 0.83986 1.00000 Ca7 Ca 0.07527 0.98273 0.16014 1.00000 Ca8 Ca 0.49722 0.70872 0.88455 1.00000 Ca9 Ca 0.75060 0.35257 0.40688 1.00000 Ca10 Ca 0.24940 0.64743 0.59312 1.00000 Ca11 Ca 0.50278 0.29128 0.11545 1.00000 Hg1 Hg 0.85401 0.42713 0.71121 1.00000 Hg2 Hg 0.14599 0.57287 0.28879 1.00000