# CIF generated by HEAS from Alexandria entry agm005755330 data_agm005755330 _cell_length_a 3.73735 _cell_length_b 8.20249 _cell_length_c 9.00607 _cell_angle_alpha 107.74063 _cell_angle_beta 101.97533 _cell_angle_gamma 90.00000 _cell_volume 256.64155 _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 0.50000 0.00000 0.00000 1.00000 Sn1 Sn 0.83528 0.66769 0.67055 1.00000 Sn2 Sn 0.16472 0.33231 0.32945 1.00000 Se1 Se 0.34452 0.91504 0.68904 1.00000 Se2 Se 0.99957 0.22142 0.99915 1.00000 Se3 Se 0.66931 0.57410 0.33861 1.00000 Se4 Se 0.00043 0.77858 0.00085 1.00000 Se5 Se 0.65548 0.08496 0.31096 1.00000 Se6 Se 0.33069 0.42590 0.66139 1.00000