# CIF generated by HEAS from Alexandria entry agm005189786 data_agm005189786 _cell_length_a 3.66486 _cell_length_b 3.66486 _cell_length_c 7.47436 _cell_angle_alpha 90.08243 _cell_angle_beta 104.10697 _cell_angle_gamma 119.99868 _cell_volume 83.40562 _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 Zr1 Zr 0.82101 0.27502 0.09602 1.00000 H1 H 0.50409 0.61661 0.12070 1.00000 S1 S 0.01247 0.87011 0.88258 1.00000 I1 I 0.35455 0.04268 0.39723 1.00000