BB6PK9 -OEChem-04012112063D 48 52 0 0 0 0 0 0 0999 V2000 -5.1796 -0.2621 0.2973 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6777 1.0153 0.1153 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 2.6426 0.1657 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6117 -0.5572 0.3336 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0068 0.6411 -0.8402 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2457 0.7997 0.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1923 1.5860 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3675 -1.4641 0.1808 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9078 -1.1608 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2472 -0.3006 0.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8824 2.2142 0.2262 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0092 1.3690 0.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1759 -0.5946 0.0755 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9635 3.3060 0.2691 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0282 0.3039 -0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5652 -1.0271 -0.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1198 -1.3226 -0.0662 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1773 -1.1032 1.3309 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2726 -0.9354 -1.0774 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8119 -0.8202 1.2967 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9071 -0.6524 -1.1116 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3916 0.5979 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5001 -2.0604 -0.2121 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3090 -0.4462 -0.1719 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8662 -1.7686 -0.2463 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9253 -0.9645 1.2999 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9024 -1.2633 -0.4548 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0707 0.1124 -1.8001 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0715 1.2081 -0.8034 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4754 1.3147 1.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1774 0.7029 -0.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5631 1.9034 -1.6888 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9146 2.4856 -0.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6419 -2.0497 -0.7081 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5695 -2.1243 1.0351 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2816 2.2255 1.1416 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2259 2.3510 -0.6396 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8408 4.0094 -0.5612 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9102 3.8711 1.2057 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8034 -2.3590 -0.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6602 -1.2747 2.2893 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8238 -0.9866 -2.0125 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2572 -0.7773 2.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4266 -0.4804 -2.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7544 1.6197 -0.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1804 -3.0978 -0.2718 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3735 -0.2308 -0.1995 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5885 -2.5758 -0.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 8 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 12 2 0 0 0 0 3 14 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 18 2 0 0 0 0 9 19 1 0 0 0 0 10 13 1 0 0 0 0 10 17 2 0 0 0 0 11 14 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 15 1 0 0 0 0 13 20 2 0 0 0 0 13 21 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 17 1 0 0 0 0 16 23 2 0 0 0 0 17 40 1 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 19 21 2 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 24 1 0 0 0 0 22 45 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 M END $$$$