# CIF generated by HEAS from Alexandria entry agm096133776 data_agm096133776 _cell_length_a 5.87119 _cell_length_b 3.59711 _cell_length_c 6.38175 _cell_angle_alpha 90.00000 _cell_angle_beta 92.23105 _cell_angle_gamma 90.00000 _cell_volume 134.67602 _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 0.00000 0.00000 0.50000 1.00000 Fe1 Fe 0.50000 0.00000 0.50000 1.00000 Fe2 Fe 0.50000 0.50000 0.00000 1.00000 Se1 Se 0.75853 0.50000 0.67942 1.00000 Se2 Se 0.73336 0.00000 0.17425 1.00000 Se3 Se 0.26664 0.00000 0.82575 1.00000 Se4 Se 0.24147 0.50000 0.32058 1.00000