# CIF generated by HEAS from Alexandria entry agm006038005 data_agm006038005 _cell_length_a 2.58386 _cell_length_b 7.03777 _cell_length_c 7.03777 _cell_angle_alpha 118.52448 _cell_angle_beta 97.02951 _cell_angle_gamma 97.02952 _cell_volume 109.17340 _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 H1 H 0.21418 0.00000 0.54570 1.00000 H2 H 0.21418 0.54570 0.00000 1.00000 H3 H 0.79472 1.00000 0.36760 1.00000 H4 H 0.79472 0.36760 1.00000 1.00000 H5 H 0.42713 0.63240 0.63240 1.00000 H6 H 0.66848 0.45430 0.45430 1.00000 Cl1 Cl 0.56604 0.00000 0.00000 1.00000 O1 O 0.82962 0.50732 1.00000 1.00000 O2 O 0.82962 1.00000 0.50732 1.00000 O3 O 0.32230 0.49268 0.49268 1.00000