RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 4.2049 0.1378 -0.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2607 0.5827 -1.2062 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4495 -0.5432 -1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5764 -1.8878 -1.1086 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8878 -2.2661 0.1163 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3471 -3.3122 0.6547 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -1.6430 0.8201 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3513 -1.1236 0.4104 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3423 -1.0552 -0.6052 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2104 0.0629 -0.6827 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8432 0.2213 -2.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1847 -0.1523 0.4689 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1612 -1.2473 0.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3329 -0.5459 1.6402 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -0.1427 1.4754 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3198 -0.6298 2.6613 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8145 -1.3495 2.2797 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7243 -1.6755 3.1309 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8235 1.2343 1.0828 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4830 2.0400 1.0254 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4422 1.2817 0.2684 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4605 1.7605 -0.6657 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6345 2.8778 -0.9541 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4848 1.3375 -0.3086 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4573 2.3698 -0.2873 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5853 1.0795 0.3736 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7015 -0.4906 0.6559 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0279 -0.4431 -0.5214 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9538 1.0621 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3964 -0.3010 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -0.7113 -2.7706 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6706 -2.0606 -1.0037 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2498 -2.6353 -1.8847 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7872 0.8204 -1.8922 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1303 0.7237 -2.6878 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1485 -0.7156 -2.5027 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7057 0.8030 0.6282 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0777 -1.0500 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4612 -1.3789 -0.8259 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -2.2476 0.5718 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6603 0.0469 2.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3858 -1.6013 1.9047 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4775 1.8224 1.7651 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8247 2.3092 2.0366 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2238 2.9797 0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0604 0.7659 1.0246 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8266 0.7099 -0.4246 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7959 1.6049 -1.0986 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6817 2.5752 0.6751 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 6 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 1 1 16 17 1 0 17 18 2 0 15 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 19 24 1 0 24 25 1 0 22 2 1 0 17 7 1 0 15 8 1 0 24 10 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 6 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 11 34 1 0 11 35 1 0 11 36 1 0 12 37 1 1 13 38 1 0 13 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 19 43 1 1 20 44 1 0 20 45 1 0 21 46 1 0 21 47 1 0 24 48 1 6 25 49 1 0 M END