M6ADRUG0055 -OEChem-08152207473D 54 57 0 1 0 0 0 0 0999 V2000 -1.8175 -5.1073 -0.3019 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5301 1.4624 1.3732 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 1.0190 2.4635 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4502 1.3473 2.2274 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1202 -2.3917 0.3309 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4871 1.7068 0.2458 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2564 -0.2595 -0.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7744 1.0130 -0.4446 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3213 1.8796 -0.9433 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8665 1.1911 -1.5410 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2837 -3.2785 0.3209 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8426 -3.0638 0.5686 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3898 1.0334 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2365 -1.0331 0.2995 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0304 -4.4315 -0.6429 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6958 -4.2268 -0.4055 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4717 3.2121 -0.9537 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 3.8520 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3284 -0.4740 0.8542 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 3.0923 0.1964 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5184 0.9931 0.8558 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4718 2.0177 -2.6565 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7628 0.0353 -0.4036 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 5.3454 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6114 -0.0794 0.6973 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8985 -0.8379 -1.4828 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5959 -1.0672 0.7192 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -1.8259 -1.4611 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7317 -1.9406 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4946 0.8167 1.8411 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5174 0.2444 -1.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4434 -3.6639 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2021 -2.7767 -0.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.3865 0.4598 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8365 -3.4390 1.5992 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8472 -5.1577 -0.5824 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9704 -4.0816 -1.6806 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6057 -3.8739 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2051 -4.8018 -0.1694 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2697 3.8777 -1.3811 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1072 -1.0421 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4524 3.5445 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7922 1.7189 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9974 2.9076 -2.2908 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 1.4366 -3.2009 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7226 2.3258 -3.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6917 5.6875 -1.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8463 5.7957 0.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6118 5.7294 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2723 -0.7986 -2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -1.1922 1.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9893 -2.5065 -2.3007 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 -2.7120 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5999 1.6225 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 21 2 0 0 0 0 3 30 1 0 0 0 0 3 54 1 0 0 0 0 4 30 2 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 13 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 13 2 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 17 2 0 0 0 0 10 22 1 0 0 0 0 10 31 1 0 0 0 0 11 15 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 16 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 14 19 2 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 20 2 0 0 0 0 18 24 1 0 0 0 0 19 21 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 25 1 0 0 0 0 23 26 2 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 27 2 0 0 0 0 25 30 1 0 0 0 0 26 28 1 0 0 0 0 26 50 1 0 0 0 0 27 29 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END $$$$