BAP9I8 -OEChem-04022117503D 57 60 0 1 0 0 0 0 0999 V2000 -3.2983 0.6676 -0.0649 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2717 -0.9120 1.8948 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -1.5898 0.7996 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5977 -2.8528 -1.8092 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0139 0.6349 -0.1796 N 0 0 2 0 0 0 0 0 0 0 0 0 3.4125 0.6947 0.8734 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7418 -1.8834 -0.9585 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5496 0.6032 -0.2986 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2518 1.8633 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4916 1.0386 -1.5044 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5255 2.1414 -1.9046 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8328 0.6174 1.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5878 -0.6414 0.2292 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0172 -0.4442 0.7278 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6469 -1.7656 1.1408 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6027 -0.4327 0.7624 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -0.1832 0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3645 -1.1239 -0.0989 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5747 0.9906 1.0313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0068 -0.8964 -0.2887 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 0.2792 0.1742 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 1.2211 0.8366 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9481 -0.7980 -0.6812 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0943 -1.9089 -1.1933 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2789 -0.9603 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2836 0.0136 -0.2954 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7396 -0.0072 1.0225 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7806 0.9608 -1.1906 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6926 0.9193 1.4455 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7337 1.8874 -0.7676 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1897 1.8667 0.5505 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2331 -0.2723 -0.8843 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0257 2.7280 -0.4781 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 1.7105 -1.7833 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4293 0.2179 -2.2307 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5205 1.4107 -1.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3413 2.1433 -2.9837 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9239 3.1253 -1.6301 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1334 1.4857 1.6434 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0633 -0.2793 1.6297 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0165 -1.0711 1.0598 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5537 -1.3809 -0.5813 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6453 0.0030 -0.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0260 0.2411 1.5842 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0164 1.6228 0.7708 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0773 -2.2367 1.9482 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6879 -2.4616 0.2968 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6691 -1.6034 1.4969 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8127 -2.0426 -0.4726 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1396 1.7402 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2149 2.1487 1.2134 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2149 -2.6845 -1.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7192 -1.8733 -1.1408 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4357 0.9894 -2.2214 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0475 0.9030 2.4717 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1208 2.6250 -1.4645 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9317 2.5881 0.8798 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 23 1 0 0 0 0 2 27 1 0 0 0 0 3 16 2 0 0 0 0 4 24 2 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 6 45 1 0 0 0 0 7 20 1 0 0 0 0 7 24 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 32 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 49 1 0 0 0 0 19 22 2 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 29 2 0 0 0 0 28 30 1 0 0 0 0 28 54 1 0 0 0 0 29 31 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 M END $$$$