# CIF generated by HEAS from Alexandria entry agm005759569 data_agm005759569 _cell_length_a 7.07417 _cell_length_b 9.78385 _cell_length_c 9.78385 _cell_angle_alpha 78.15588 _cell_angle_beta 95.69629 _cell_angle_gamma 95.69629 _cell_volume 657.30927 _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 0.25000 0.89809 0.10191 1.00000 Ti2 Ti 0.75000 0.10191 0.89809 1.00000 Cu1 Cu 0.06448 0.37532 0.53165 1.00000 Cu2 Cu 0.43552 0.46835 0.62468 1.00000 Cu3 Cu 0.93552 0.62468 0.46835 1.00000 Cu4 Cu 0.56448 0.53165 0.37532 1.00000 I1 I 0.37062 0.28651 0.46024 1.00000 I2 I 0.12938 0.53976 0.71349 1.00000 I3 I 0.62938 0.71349 0.53976 1.00000 I4 I 0.87062 0.46024 0.28651 1.00000 I5 I 0.86457 0.13415 0.64264 1.00000 I6 I 0.63543 0.35736 0.86585 1.00000 I7 I 0.13543 0.86585 0.35736 1.00000 I8 I 0.36457 0.64264 0.13415 1.00000 I9 I 0.09899 0.17488 0.03063 1.00000 I10 I 0.40101 0.96937 0.82512 1.00000 I11 I 0.90101 0.82512 0.96937 1.00000 I12 I 0.59899 0.03063 0.17488 1.00000