RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 -6.1009 -2.1761 -2.0896 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5502 -1.3572 -0.9777 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4907 -1.5821 -0.1046 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4112 -0.4360 0.7394 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 0.4268 0.4105 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0648 -0.1454 -0.6011 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2065 0.5440 -1.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5042 -0.0607 1.8517 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7808 0.8486 2.6402 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3061 -0.7339 1.9689 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1992 -0.1593 2.8046 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2167 0.8229 2.0963 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7185 -0.2794 2.0627 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0756 -1.0642 2.9518 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3423 -2.0694 3.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9713 -0.1511 1.5446 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2178 0.7759 0.5799 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1652 1.7149 0.0107 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.2923 0.3799 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 1.0074 0.0383 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7383 0.5865 -1.7295 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4546 0.7519 -2.0372 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0438 0.0431 -2.9807 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3961 0.3155 -3.0887 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7715 1.2522 -2.2456 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4987 1.8903 -1.2772 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1611 1.7504 -2.0982 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1434 -1.0289 2.0839 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7893 -0.4814 3.0285 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3742 -2.0840 1.4325 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.6925 -2.7621 -0.1055 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.2532 -3.8187 -0.4184 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -2.6360 0.1920 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.7394 -1.5941 -2.7607 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7009 -3.0006 -1.6917 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2933 -2.5988 -2.6922 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4495 1.4154 -0.5477 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9450 0.8638 -2.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0550 -0.1460 -1.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0165 -1.3689 1.2209 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5639 0.1980 3.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1117 1.6520 2.7372 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3562 2.7272 0.3839 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2257 1.7556 -1.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8692 2.0692 0.1763 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3884 0.4330 0.5693 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3073 2.6548 -2.6977 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8729 0.9920 -2.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3993 1.9810 -1.0527 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 1 0 4 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 13 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 17 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 25 27 1 0 16 28 1 0 28 29 2 0 28 30 1 0 3 31 1 0 31 32 2 0 31 33 1 0 6 2 1 0 14 11 1 0 19 12 1 0 26 22 1 0 1 34 1 0 1 35 1 0 1 36 1 0 7 37 1 0 7 38 1 0 7 39 1 0 10 40 1 0 11 41 1 1 12 42 1 1 18 43 1 0 18 44 1 0 20 45 1 0 20 46 1 0 27 47 1 0 27 48 1 0 27 49 1 0 M CHG 3 30 -1 31 1 33 -1 M END