RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 -2.7579 3.2161 2.8556 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 3.5842 1.7924 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4757 2.9196 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5502 1.8709 0.3866 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 1.5180 1.4711 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8342 2.1868 2.6935 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5118 1.1371 -0.9502 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1905 1.2926 -1.7598 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 0.4786 -1.3318 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9803 1.0488 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9418 2.1798 -0.1483 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1267 0.0933 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4031 0.8480 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4871 -0.0473 0.3997 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3245 0.3918 1.5036 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0773 -0.7235 2.0351 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6732 -1.5173 1.1156 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2341 -1.6092 -0.1847 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0389 -2.5042 -0.9528 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0481 -3.0620 -0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0176 -2.5051 1.4280 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0677 -0.8494 -0.6005 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6066 -0.9433 -1.7347 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0567 -0.2719 -0.8046 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3465 -0.6482 -0.9103 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 0.0282 -1.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7230 -0.6776 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7432 -2.0986 -0.8321 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6349 -2.8078 -0.5554 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3535 -2.0841 -0.5712 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1866 -2.5280 -0.3054 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.1926 -1.4460 -0.4312 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8306 3.7376 3.8048 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2931 4.3939 1.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1288 3.2385 -0.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9861 0.7340 1.3851 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 1.9126 3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2349 1.6641 -1.5924 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8922 2.3476 -1.7929 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3854 0.9856 -2.7954 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2495 -0.2339 -1.9869 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2725 -0.5287 -1.2524 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8354 -0.5710 0.4577 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7472 1.4535 -0.8483 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2002 1.5383 0.8315 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 0.7877 2.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9916 1.1858 1.1526 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6238 -0.5007 2.8629 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8759 -2.7294 -2.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8033 -3.7688 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5886 1.0905 -1.4053 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -0.1937 -1.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7231 -2.5804 -0.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6788 -3.8641 -0.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -3.4943 -0.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4948 -1.7364 -1.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6928 -1.3389 0.5357 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 4 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 18 22 1 0 22 23 2 0 7 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 6 1 1 0 22 14 1 0 21 17 1 0 32 24 1 0 30 25 1 0 1 33 1 0 2 34 1 0 3 35 1 0 5 36 1 0 6 37 1 0 7 38 1 6 8 39 1 0 8 40 1 0 9 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 15 46 1 0 15 47 1 0 16 48 1 0 19 49 1 0 20 50 1 0 26 51 1 0 27 52 1 0 28 53 1 0 29 54 1 0 31 55 1 0 32 56 1 0 32 57 1 0 M CHG 1 31 1 M END