# CIF generated by HEAS from Alexandria entry agm080750592 data_agm080750592 _cell_length_a 11.33128 _cell_length_b 9.54106 _cell_length_c 11.30521 _cell_angle_alpha 90.51602 _cell_angle_beta 85.88332 _cell_angle_gamma 91.39602 _cell_volume 1218.68651 _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 Ti1 Ti 0.28793 0.42272 0.49616 1.00000 Ti2 Ti 0.77913 0.17496 0.50287 1.00000 Ti3 Ti 0.21512 0.67783 0.99791 1.00000 Ti4 Ti 0.71804 0.92372 0.00316 1.00000 I1 I 0.46476 0.58114 0.54038 1.00000 I2 I 0.94926 0.00886 0.45183 1.00000 I3 I 0.03348 0.51905 0.04602 1.00000 I4 I 0.54814 0.08552 0.96620 1.00000 I5 I 0.33736 0.28057 0.30720 1.00000 I6 I 0.82158 0.31976 0.68706 1.00000 I7 I 0.18631 0.81924 0.81160 1.00000 I8 I 0.66585 0.78184 0.19106 1.00000 I9 I 0.24271 0.84587 0.17192 1.00000 I10 I 0.39870 0.52878 0.96227 1.00000 I11 I 0.58662 0.03293 0.54333 1.00000 I12 I 0.75859 0.33943 0.32844 1.00000 I13 I 0.75324 0.75756 0.82615 1.00000 I14 I 0.10800 0.57276 0.46872 1.00000 I15 I 0.90647 0.07095 0.02791 1.00000 I16 I 0.23873 0.25651 0.66982 1.00000