RDKit 3D 58 60 0 0 0 0 0 0 0 0999 V2000 5.2796 2.1140 0.8423 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2821 1.0286 0.5933 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5523 -0.2315 -0.0681 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3354 -0.9015 -0.1283 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3919 -0.1312 0.5017 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 1.0363 0.9828 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2048 2.0523 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7135 3.1352 2.0527 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7868 1.7140 2.2338 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3906 2.5741 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4183 2.0308 0.8952 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0001 0.4316 0.5647 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3973 -0.6589 0.9713 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1341 -1.7217 0.5426 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1678 -1.2671 -0.1454 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1446 0.1163 -0.1389 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 1.0900 -0.6298 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1815 1.4463 0.4595 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6627 2.8954 0.2949 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3974 0.5227 0.5359 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5121 0.8272 -2.0842 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7455 0.8279 -2.3477 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5355 0.6921 -2.8812 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.1450 -2.1679 -0.6725 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0092 -2.9523 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -3.8028 -0.7388 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4982 -3.6790 -2.0746 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2265 -2.5664 -2.3326 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9423 -2.2133 -0.7145 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8459 -0.7172 -0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9099 -0.1374 -0.3825 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7503 -1.9030 -1.2425 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9883 -2.4260 -1.7085 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7582 1.9736 1.8167 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0527 2.1305 0.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8153 3.1028 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4163 -0.4068 0.5878 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7784 0.6755 2.5806 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 3.6452 3.1955 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5958 2.2873 3.8167 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1097 2.4417 4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5435 2.0108 -0.7632 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6879 1.3935 1.4423 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 3.1532 1.0661 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8258 3.5952 0.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1305 3.0559 -0.6831 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1034 0.6965 -0.2856 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1115 -0.5285 0.5302 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9444 0.7030 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0663 -2.8997 1.1511 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5727 -4.4756 -0.3632 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -4.2009 -2.9145 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4567 -3.0306 -0.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8658 -2.3945 -0.6236 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1921 -2.2498 -1.7796 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7917 -3.3858 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4338 -1.7549 -2.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6735 -2.5951 -0.8732 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 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 17 21 1 0 21 22 2 0 21 23 1 0 15 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 4 29 1 0 3 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 6 2 2 0 16 12 1 0 28 24 1 0 1 34 1 0 1 35 1 0 1 36 1 0 5 37 1 0 9 38 1 1 10 39 1 0 10 40 1 0 10 41 1 0 17 42 1 6 18 43 1 0 19 44 1 0 19 45 1 0 19 46 1 0 20 47 1 0 20 48 1 0 20 49 1 0 25 50 1 0 26 51 1 0 27 52 1 0 29 53 1 0 29 54 1 0 29 55 1 0 33 56 1 0 33 57 1 0 33 58 1 0 M CHG 1 23 -1 M END