# CIF generated by HEAS from Alexandria entry agm005263213 data_agm005263213 _cell_length_a 12.52840 _cell_length_b 8.22776 _cell_length_c 7.18417 _cell_angle_alpha 65.14871 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 671.97572 _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 0.33797 0.49321 0.85773 1.00000 H2 H 0.26246 0.52977 0.65788 1.00000 H3 H 0.83797 0.50679 0.14227 1.00000 H4 H 0.76246 0.47023 0.34212 1.00000 H5 H 0.30952 0.42856 0.45011 1.00000 H6 H 0.18190 0.40593 0.50582 1.00000 H7 H 0.80952 0.57144 0.54989 1.00000 H8 H 0.68190 0.59407 0.49418 1.00000 H9 H 0.15092 0.79307 0.04957 1.00000 H10 H 0.22276 0.67872 0.24177 1.00000 H11 H 0.65092 0.20693 0.95043 1.00000 H12 H 0.72276 0.32128 0.75823 1.00000 H13 H 0.31288 0.11552 0.17289 1.00000 H14 H 0.23778 0.94709 0.18834 1.00000 H15 H 0.81288 0.88448 0.82711 1.00000 H16 H 0.73778 0.05291 0.81166 1.00000 H17 H 0.27657 0.71004 0.73014 1.00000 H18 H 0.26919 0.94314 0.50586 1.00000 H19 H 0.77657 0.28996 0.26986 1.00000 H20 H 0.76919 0.05686 0.49414 1.00000 H21 H 0.43673 0.08297 0.87579 1.00000 H22 H 0.32329 0.94178 0.71122 1.00000 H23 H 0.93673 0.91703 0.12421 1.00000 H24 H 0.82329 0.05822 0.28878 1.00000 H25 H 0.55826 0.77612 0.66596 1.00000 H26 H 0.51698 0.90585 0.77916 1.00000 H27 H 0.64914 0.86061 0.77939 1.00000 H28 H 0.05826 0.22388 0.33404 1.00000 H29 H 0.14914 0.13939 0.22061 1.00000 H30 H 0.01698 0.09415 0.22084 1.00000 H31 H 0.47639 0.46575 0.42582 1.00000 H32 H 0.44390 0.16570 0.63423 1.00000 H33 H 0.45156 0.34738 0.30097 1.00000 H34 H 0.95156 0.65262 0.69903 1.00000 H35 H 0.97639 0.53425 0.57418 1.00000 H36 H 0.94390 0.83430 0.36577 1.00000 Br1 Br 0.53055 0.73289 0.40551 1.00000 Br2 Br 0.03055 0.26711 0.59449 1.00000 Br3 Br 0.45890 0.28442 0.02590 1.00000 Br4 Br 0.95890 0.71558 0.97410 1.00000 O1 O 0.27278 0.55921 0.78360 1.00000 O2 O 0.77278 0.44079 0.21640 1.00000 O3 O 0.24446 0.49009 0.47035 1.00000 O4 O 0.74446 0.50991 0.52965 1.00000 O5 O 0.21751 0.79602 0.11989 1.00000 O6 O 0.71751 0.20398 0.88011 1.00000 O7 O 0.24953 0.04289 0.24422 1.00000 O8 O 0.74953 0.95711 0.75578 1.00000 O9 O 0.26848 0.88371 0.65928 1.00000 O10 O 0.76848 0.11629 0.34072 1.00000 O11 O 0.43568 0.04814 0.75943 1.00000 O12 O 0.93568 0.95186 0.24057 1.00000 O13 O 0.57132 0.80696 0.78847 1.00000 O14 O 0.07132 0.19304 0.21153 1.00000 O15 O 0.43645 0.35853 0.43113 1.00000 O16 O 0.93645 0.64147 0.56887 1.00000