RDKit 3D 56 60 0 0 0 0 0 0 0 0999 V2000 8.0039 2.0809 1.1214 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6452 1.5740 0.7323 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9664 2.1401 -0.3521 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 1.7013 -0.7062 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0605 0.6822 0.0419 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 0.1411 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0275 0.5724 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7459 -1.0517 1.8622 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5197 -0.7690 0.7048 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8064 0.1504 -0.1966 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3254 -1.4666 0.7107 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -1.2780 -0.2823 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6505 -2.3673 0.0458 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3284 -3.1065 1.1188 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9846 -2.4874 1.6017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6013 -2.8521 2.5937 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8269 -4.1163 1.6801 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.7933 -2.5956 -0.8726 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5791 -2.4796 -2.0833 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1131 -2.8962 -0.3522 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0454 -3.8153 -0.8122 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2567 -3.8175 -0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2023 -2.9535 0.8675 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -2.0071 0.9583 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2896 -2.7481 1.8597 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8792 -4.7946 -1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3498 0.1040 -0.2246 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4793 0.8610 -1.4005 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0772 2.1243 -1.3754 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5662 2.6500 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4526 1.8963 1.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8489 0.6357 0.9774 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2081 3.9905 -0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6677 4.4627 0.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1992 4.6034 -1.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7911 5.9023 -1.2994 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5919 1.2917 1.6033 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9048 2.9204 1.8156 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5638 2.4119 0.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4279 2.9323 -0.9381 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1595 2.1385 -1.5499 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5224 0.1399 2.3619 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7556 -1.4532 -1.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9617 -3.6143 1.8714 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8805 -1.8601 1.6053 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 -2.6256 2.8741 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0376 -4.5502 -2.5754 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7836 -4.8216 -2.5385 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7116 -5.7966 -1.5109 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1124 0.4659 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1546 2.6827 -2.3052 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8323 2.2829 1.9477 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7745 0.0641 1.9032 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7242 6.3067 -2.3137 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 5.8440 -1.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2467 6.5704 -0.6248 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 6 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 14 17 1 0 13 18 1 0 18 19 2 0 18 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 23 25 1 0 21 26 1 0 12 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 30 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 7 2 1 0 10 5 1 0 15 11 1 0 24 20 1 0 32 27 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 0 4 41 1 0 7 42 1 0 12 43 1 6 25 44 1 0 25 45 1 0 25 46 1 0 26 47 1 0 26 48 1 0 26 49 1 0 28 50 1 0 29 51 1 0 31 52 1 0 32 53 1 0 36 54 1 0 36 55 1 0 36 56 1 0 M CHG 1 17 -1 M END