B0DM5Y -OEChem-04022109112D 47 50 0 0 0 0 0 0 0999 V2000 5.5443 1.1180 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 -3.2734 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 2.7888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 1.0567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 3.6780 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 -4.1394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 2.7275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 1.9227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 1.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 0.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 1.9227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.9227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 -1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 -0.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 0.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 -1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 -0.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 -2.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 -2.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 -3.2734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1279 -3.2734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 -4.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2105 1.2688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5202 1.6673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3179 0.5198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 3.9227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 3.9227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0079 -0.6753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4379 0.7276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4616 3.8058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4409 4.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 3.4597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.2327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.3858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8179 -2.0783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2479 -0.6753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9379 -1.8705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7479 -3.2734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9379 -4.6764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 27 1 0 0 0 0 3 17 2 0 0 0 0 4 14 1 0 0 0 0 4 17 1 0 0 0 0 4 32 1 0 0 0 0 5 7 2 0 0 0 0 5 13 1 0 0 0 0 6 10 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 15 1 0 0 0 0 8 27 1 0 0 0 0 8 29 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 2 0 0 0 0 10 12 2 0 0 0 0 11 15 2 0 0 0 0 11 18 1 0 0 0 0 12 17 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 22 1 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 23 2 0 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 20 23 1 0 0 0 0 20 36 1 0 0 0 0 21 24 2 0 0 0 0 21 37 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 28 2 0 0 0 0 26 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M END $$$$