RDKit 3D 46 49 0 0 0 0 0 0 0 0999 V2000 -1.1894 -4.2605 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0585 -3.1336 -2.0365 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5149 -2.0182 -1.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3376 -1.8873 -1.1232 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5274 -0.8862 -1.4218 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9003 0.2999 -0.6872 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0950 0.9982 -0.1992 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0521 -0.0105 0.1109 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6589 -1.2343 -0.5518 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8779 1.9231 0.7943 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9259 3.3318 0.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5419 3.9634 1.6812 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3403 2.9556 2.6221 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4576 1.6939 2.0436 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 3.9306 -0.5949 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0035 1.1409 -1.6044 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3595 1.9882 -0.6942 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 0.7088 -0.6504 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4458 -0.4909 0.2113 N 0 0 0 0 0 4 0 0 0 0 0 0 2.3929 -0.5962 1.0616 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6453 -1.5965 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7757 -1.4300 2.8033 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 -0.3297 2.6002 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5614 0.6377 1.6729 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3627 0.5197 0.8469 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9536 1.2373 -0.1289 N 0 0 0 0 0 4 0 0 0 0 0 0 5.9501 -0.2508 3.4193 N 0 0 0 0 0 4 0 0 0 0 0 0 6.1981 -1.2125 4.1489 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6432 0.7649 3.3038 O 0 0 0 0 0 1 0 0 0 0 0 0 -0.5147 -4.0917 -3.0327 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -4.4437 -1.2714 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8024 -5.1400 -2.3984 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8608 -0.6137 -2.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3233 -0.0716 0.1768 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0178 0.2987 -0.0927 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4211 -1.6622 -1.0876 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 3.4759 -1.1296 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4501 4.9293 -0.5276 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5905 1.9150 -2.1105 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5369 0.5378 -2.3907 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 0.3465 -1.6658 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7075 -1.2000 0.0747 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -2.4231 2.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0112 -2.1501 3.5918 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2641 1.4509 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4256 2.0854 -0.4597 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 7 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 11 15 1 0 6 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 23 27 1 0 27 28 2 0 27 29 1 0 9 5 1 0 14 10 2 0 26 18 1 0 25 20 1 0 1 30 1 0 1 31 1 0 1 32 1 0 5 33 1 6 6 34 1 1 8 35 1 0 9 36 1 0 15 37 1 0 15 38 1 0 16 39 1 0 16 40 1 0 18 41 1 6 19 42 1 0 21 43 1 0 22 44 1 0 24 45 1 0 26 46 1 0 M CHG 4 19 1 26 1 27 1 29 -1 M END