# CIF generated by HEAS from Alexandria entry agm005189813 data_agm005189813 _cell_length_a 3.96700 _cell_length_b 3.96769 _cell_length_c 8.18732 _cell_angle_alpha 76.01482 _cell_angle_beta 75.97973 _cell_angle_gamma 60.00570 _cell_volume 107.16339 _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 Tm1 Tm 0.11033 0.39416 0.38517 1.00000 H1 H 0.76756 0.05162 0.41327 1.00000 I1 I 0.99254 0.28018 0.73474 1.00000 Cl1 Cl 0.50765 0.79109 0.19361 1.00000