RDKit 3D 52 56 0 0 0 0 0 0 0 0999 V2000 -7.6009 0.9579 1.9928 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2373 0.6542 1.5198 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2491 -0.2029 1.9517 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1642 -0.0483 1.0647 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8759 -0.6654 0.9001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4008 -1.5705 1.5748 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1758 -0.1531 -0.1776 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6465 0.8405 -1.0125 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8089 1.4069 -0.8865 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5339 0.9275 0.1551 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8009 1.3545 0.4306 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7412 1.2399 -2.1589 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2929 2.1604 -1.5657 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9019 0.8795 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4456 -0.3203 -1.2203 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3851 -1.2890 -1.1438 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -1.1115 -1.2517 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4303 -2.3405 -1.1339 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5667 -3.3828 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9542 -2.9401 -0.9082 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2282 -4.6997 -0.8025 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7159 -4.2630 -0.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8374 -2.8054 -1.1666 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2483 0.2266 -1.4597 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4518 0.4588 -1.5501 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2548 1.2133 -1.5549 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 2.5858 -1.7211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2795 3.1787 -0.4037 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1907 3.3494 0.5044 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6179 3.8719 1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3518 -1.1434 3.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4297 -1.8075 3.2762 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3833 -1.1206 3.9935 O 0 0 0 0 0 1 0 0 0 0 0 0 -7.7755 2.0394 1.9942 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3417 0.4950 1.3335 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7687 0.5905 3.0095 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2531 -0.5506 -0.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4593 0.3584 -2.7421 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2997 1.9018 -2.8303 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1138 -5.2906 -1.7166 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8748 -5.2759 0.0572 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4145 -4.9496 -1.1031 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9547 -4.2578 0.4569 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -2.2009 -0.5424 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2128 -2.8149 -2.1948 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5857 2.5625 -2.4467 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9973 3.2399 -2.1467 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7333 4.1573 -0.6034 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0356 2.5288 0.0494 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0866 4.8526 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3185 3.1840 2.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7421 3.9885 2.3982 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 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 8 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 17 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 3 31 1 0 31 32 2 0 31 33 1 0 11 2 1 0 10 4 2 0 26 14 1 0 20 16 1 0 23 18 1 0 1 34 1 0 1 35 1 0 1 36 1 0 7 37 1 0 12 38 1 0 12 39 1 0 21 40 1 0 21 41 1 0 22 42 1 0 22 43 1 0 23 44 1 0 23 45 1 0 27 46 1 0 27 47 1 0 28 48 1 0 28 49 1 0 30 50 1 0 30 51 1 0 30 52 1 0 M CHG 1 33 -1 M END