BPUT52 -OEChem-04022102343D 22 23 0 1 0 0 0 0 0999 V2000 2.9860 -1.1141 0.6318 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 0.6293 -0.6218 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7751 1.2619 -0.2721 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6587 -0.5661 -0.3876 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2085 -1.3493 0.8035 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7985 -0.2086 -0.1832 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7978 -1.0795 -0.6179 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1417 0.9911 0.4402 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7091 0.4165 -0.1858 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1401 -0.7505 -0.4294 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 1.3201 0.6287 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4832 0.4491 0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7286 -1.1784 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8884 -0.9273 1.7623 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9306 -2.4068 0.7725 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5435 -2.0182 -1.1026 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3822 1.6803 0.7986 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9181 -1.4288 -0.7672 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7516 2.2527 1.1167 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5284 0.7048 0.3415 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6802 1.0101 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6941 2.1683 -0.7198 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 9 1 0 0 0 0 2 4 1 0 0 0 0 2 9 2 0 0 0 0 3 9 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 10 1 0 0 0 0 7 16 1 0 0 0 0 8 11 2 0 0 0 0 8 17 1 0 0 0 0 10 12 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 20 1 0 0 0 0 M END $$$$