B86DPI -OEChem-04022113463D 54 57 0 1 0 0 0 0 0999 V2000 2.6526 -2.3125 0.3056 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9657 -2.9085 -0.9771 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5153 -2.4969 1.4547 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8136 2.8782 -0.7581 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 1.3230 0.4178 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0556 -2.7182 0.7352 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4512 -0.5639 0.0551 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2321 1.2053 -1.2804 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7808 1.6166 1.1485 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6271 1.5796 -0.5736 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7289 1.8322 0.0384 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4174 -0.3086 -1.0621 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9647 0.1014 1.3599 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7969 0.0666 -0.3558 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5885 1.8168 -1.6824 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 2.2255 0.7318 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7557 1.8963 -0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0227 1.1861 0.5182 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2807 1.8835 -0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0485 1.3892 2.0504 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0476 -0.2823 0.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0552 -0.5937 -1.2928 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0627 -1.3038 1.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0778 -1.9267 -1.7029 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0853 -2.6368 0.6064 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0929 -2.9483 -0.7533 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5032 1.3697 -2.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4423 2.0761 2.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5866 2.0212 -0.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6198 2.9136 -0.1194 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4483 -0.7653 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7495 -0.7675 -2.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7028 -0.0544 2.1584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -0.3471 1.7351 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1756 -0.3978 -1.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5579 -0.1117 0.4147 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4719 2.8925 -1.8615 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9357 1.3726 -2.6233 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8737 2.0756 1.5277 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 3.3086 0.5957 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6194 0.4777 0.9752 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3348 -2.7886 0.0082 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -2.5115 1.6805 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3386 2.9260 0.2876 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1972 1.3779 0.2786 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2902 1.9096 -1.1442 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0008 2.4569 2.2992 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 0.9181 2.5543 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9687 0.9934 2.4961 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0311 0.1845 -2.0503 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0576 -1.1148 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0801 -2.1695 -2.7615 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 -3.4329 1.3451 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -3.9862 -1.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 4 17 2 0 0 0 0 5 11 1 0 0 0 0 5 17 1 0 0 0 0 5 41 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 15 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 9 28 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 50 1 0 0 0 0 23 25 2 0 0 0 0 23 51 1 0 0 0 0 24 26 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 M END $$$$