BC87JM -OEChem-04012113143D 44 47 0 0 0 0 0 0 0999 V2000 -7.0779 0.2909 0.0138 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7738 1.9042 -0.2789 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2793 0.0071 -0.0641 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1305 2.0389 -0.2744 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1233 -0.6049 -1.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8879 1.1677 0.5963 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5013 -0.9012 -0.5218 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2850 0.7998 1.0866 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9233 -0.2303 -0.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6668 -0.1759 0.0345 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2145 -0.0404 0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1732 1.1155 -0.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.7077 0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2516 -0.2088 1.2033 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2215 -0.4923 -1.1958 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2551 -0.9617 0.1199 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5187 -1.2531 0.1894 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8783 -0.4491 1.2489 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8483 -0.7327 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8835 1.4102 -0.1995 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5283 1.3813 -0.1627 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8957 -1.0064 0.1675 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3954 0.2981 -0.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0381 -2.6492 0.3763 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7019 -1.5495 -1.4629 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 0.0869 -1.9463 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9519 1.9846 -0.1331 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2967 1.5308 1.4433 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1660 -1.2717 -1.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4527 -1.6661 0.2627 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2418 0.0554 1.8909 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7872 1.6881 1.4827 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -0.0257 2.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7096 -0.4975 -2.1667 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4918 -2.0094 0.2671 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3666 -0.4338 2.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3113 -0.9316 -2.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2767 3.0323 -0.4098 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9117 2.3861 -0.2972 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6063 -1.8215 0.2851 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4698 0.4619 -0.0201 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -2.9761 -0.4896 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8714 -3.3534 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4386 -2.7325 1.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 20 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 4 12 1 0 0 0 0 4 20 1 0 0 0 0 4 38 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 2 0 0 0 0 11 16 2 0 0 0 0 11 20 1 0 0 0 0 12 21 2 0 0 0 0 13 16 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 18 1 0 0 0 0 14 33 1 0 0 0 0 15 19 2 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 22 1 0 0 0 0 17 24 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END $$$$