RDKit 3D 58 62 0 0 0 0 0 0 0 0999 V2000 -4.6590 1.5589 -1.3395 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1883 1.7427 0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9709 2.5617 0.9158 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5976 2.8154 2.2348 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4351 2.2535 2.7434 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6575 1.4263 1.9349 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0223 1.1412 0.6034 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1735 0.2578 -0.1076 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1857 0.9419 -0.9540 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0767 0.1181 -2.1621 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0665 -0.8434 -2.1335 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6385 -0.7585 -0.9451 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6836 -1.7453 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3155 -2.4950 -1.5534 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -3.4334 -1.1872 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5699 -3.6130 0.1091 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.9726 -2.9156 1.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0086 -1.9668 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4017 1.1934 -0.1239 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1009 -0.5105 -0.1077 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4814 -1.3842 0.9777 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6142 -0.3651 0.1073 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 -0.3035 1.3063 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -0.1418 1.5636 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8831 -0.1143 2.6997 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2907 -0.0001 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6144 0.1984 0.2477 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1434 0.3011 -1.1637 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6940 0.0324 -2.2415 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6076 -0.1019 -0.8963 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3491 -0.2848 -1.0481 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7668 1.6549 -1.4837 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6152 0.2965 1.3594 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2107 0.6202 -1.4385 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8255 1.5759 -2.0461 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3283 2.3732 -1.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8766 3.0323 0.5348 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2056 3.4675 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1271 2.4642 3.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7482 0.9956 2.3528 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 1.9326 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1013 0.6865 -3.0073 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0652 -2.3533 -2.6035 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7985 -4.0506 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2736 -4.3108 0.3595 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2755 -3.1394 2.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5123 -1.4255 1.5801 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9648 -0.9856 -1.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0423 -2.3208 1.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5488 -1.6592 0.7419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4896 -0.8946 1.9581 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8635 -0.5019 -1.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0822 2.4846 -1.2713 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6707 1.8159 -0.8859 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0639 1.7165 -2.5366 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2166 -0.0008 2.3306 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4666 -0.3616 1.1552 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9863 1.3224 1.4489 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 9 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 2 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 28 32 1 0 27 33 1 0 7 2 1 0 12 8 1 0 18 13 1 0 31 22 1 0 30 26 1 0 1 34 1 0 1 35 1 0 1 36 1 0 3 37 1 0 4 38 1 0 5 39 1 0 6 40 1 0 9 41 1 6 10 42 1 0 14 43 1 0 15 44 1 0 16 45 1 0 17 46 1 0 18 47 1 0 20 48 1 6 21 49 1 0 21 50 1 0 21 51 1 0 28 52 1 6 32 53 1 0 32 54 1 0 32 55 1 0 33 56 1 0 33 57 1 0 33 58 1 0 M CHG 1 16 1 M END