# CIF generated by HEAS from Alexandria entry agm005802702 data_agm005802702 _cell_length_a 5.71717 _cell_length_b 8.42471 _cell_length_c 8.42471 _cell_angle_alpha 113.56981 _cell_angle_beta 100.03377 _cell_angle_gamma 100.03377 _cell_volume 352.61409 _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 0.85346 0.63534 0.78091 1.00000 Ca2 Ca 0.06193 0.94465 0.28496 1.00000 Ca3 Ca 0.64654 0.21909 0.36466 1.00000 Ca4 Ca 0.43807 0.71504 0.05535 1.00000 Ca5 Ca 0.56193 0.28496 0.94465 1.00000 Ca6 Ca 0.35346 0.78091 0.63534 1.00000 Ca7 Ca 0.93807 0.05535 0.71504 1.00000 Ca8 Ca 0.14654 0.36466 0.21909 1.00000 Tl1 Tl 0.75000 0.63232 0.36768 1.00000 Tl2 Tl 0.25000 0.36768 0.63232 1.00000 Ru1 Ru 0.25000 0.99847 0.00153 1.00000 Ru2 Ru 0.75000 0.00153 0.99847 1.00000