# CIF generated by HEAS from Alexandria entry agm005249147 data_agm005249147 _cell_length_a 5.68069 _cell_length_b 10.08491 _cell_length_c 10.39832 _cell_angle_alpha 87.33462 _cell_angle_beta 74.14795 _cell_angle_gamma 80.19799 _cell_volume 564.69186 _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 0.80099 0.84564 0.05413 1.00000 H2 H 0.85512 0.34564 0.94587 1.00000 H3 H 0.80396 0.74247 0.91701 1.00000 H4 H 0.72098 0.24247 0.08299 1.00000 H5 H 0.47943 0.82354 0.27451 1.00000 H6 H 0.75395 0.32354 0.72549 1.00000 H7 H 0.29701 0.30121 0.34139 1.00000 H8 H 0.63839 0.80121 0.65861 1.00000 H9 H 0.06230 0.39942 0.46887 1.00000 H10 H 0.53118 0.89942 0.53113 1.00000 H11 H 0.04864 0.11987 0.31885 1.00000 H12 H 0.36749 0.61987 0.68115 1.00000 H13 H 0.80107 0.11088 0.46822 1.00000 H14 H 0.26929 0.61088 0.53178 1.00000 H15 H 0.00678 0.96014 0.39798 1.00000 H16 H 0.40475 0.46014 0.60202 1.00000 C1 C 0.55137 0.71541 0.09258 1.00000 C2 C 0.64395 0.21541 0.90742 1.00000 C3 C 0.23946 0.58490 0.20926 1.00000 C4 C 0.44872 0.08490 0.79074 1.00000 C5 C 0.91298 0.05913 0.37569 1.00000 C6 C 0.28868 0.55913 0.62431 1.00000 S1 S 0.42588 0.58633 0.04548 1.00000 S2 S 0.47136 0.08633 0.95452 1.00000 S3 S 0.04126 0.45934 0.25899 1.00000 S4 S 0.30024 0.95934 0.74101 1.00000 S5 S 0.71438 0.03651 0.27626 1.00000 S6 S 0.99064 0.53651 0.72374 1.00000 N1 N 0.73312 0.77191 0.01556 1.00000 N2 N 0.74868 0.27191 0.98444 1.00000 N3 N 0.26369 0.67421 0.28841 1.00000 N4 N 0.55211 0.17421 0.71159 1.00000 N5 N 0.43623 0.74840 0.22196 1.00000 N6 N 0.65819 0.24840 0.77804 1.00000 N7 N 0.13289 0.36760 0.37077 1.00000 N8 N 0.50366 0.86760 0.62923 1.00000 O1 O 0.09847 0.38120 0.13813 1.00000 O2 O 0.23660 0.88120 0.86187 1.00000 O3 O 0.79512 0.52980 0.31840 1.00000 O4 O 0.11351 0.02980 0.68160 1.00000 O5 O 0.87005 0.97075 0.15131 1.00000 O6 O 0.02135 0.47075 0.84869 1.00000 O7 O 0.53940 0.94976 0.35668 1.00000 O8 O 0.89608 0.44976 0.64332 1.00000 O9 O 0.58388 0.17165 0.25226 1.00000 O10 O 0.83615 0.67165 0.74774 1.00000