marinedrugs-11-02382-s004.mol corina 04141405353D 1 1.00000 0.00000 CORINA 3.49 0023 12.04.2013 43 42 0 0 0 0 0 0 0 0999 V2000 -4.5338 -2.1305 0.2016 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0667 -2.4218 0.5236 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2637 -2.4258 -0.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9375 -2.6622 -0.7122 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1749 -2.7684 -1.9585 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6523 -0.8069 -0.3238 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 -2.2162 -1.8135 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2888 -2.4109 -1.6929 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2605 -4.1793 -2.4811 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -4.5137 -3.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3817 -0.9753 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5654 -0.4694 -0.8445 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2858 -5.8852 -4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3606 -6.7434 -3.4628 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -6.7911 -1.9545 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0223 -6.8647 -6.3834 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5028 -5.8826 -5.6243 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2332 -7.5328 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2238 -7.7000 0.0574 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5268 -5.4362 -7.9846 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6726 -6.0522 -8.5757 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -6.9296 -7.8139 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 -5.9743 -9.6501 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5787 -8.4606 -9.7666 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1527 -8.3742 -8.2997 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1499 -4.9967 -6.1413 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1471 -7.9793 -1.9405 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8959 -5.0140 -1.8724 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3914 -0.2752 -1.2421 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3132 -8.0684 -3.9958 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0689 -8.1349 -9.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3228 -9.8756 -10.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9549 -2.0026 6.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1194 -1.8837 4.8678 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6378 -2.0519 5.2107 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8023 -1.9331 3.9346 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3207 -2.1012 4.2775 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4851 -1.9824 3.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0036 -2.1506 3.3443 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1680 -2.0318 2.0681 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6865 -2.1999 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8509 -2.0811 1.1349 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3694 -2.2493 1.4778 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 1 6 1 0 3 7 2 0 5 8 1 0 5 9 1 0 9 10 1 0 8 11 1 0 11 12 1 0 10 13 1 0 13 14 1 0 14 15 1 0 16 17 1 0 17 13 1 0 15 18 1 0 18 19 1 0 20 21 2 0 21 22 1 0 22 16 1 0 21 23 1 0 24 25 1 0 22 25 1 0 17 26 2 0 18 27 2 0 9 28 2 0 11 29 2 0 14 30 1 0 24 31 1 0 24 32 1 0 1 43 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 11 33 34 35 36 37 38 39 40 41 42 43 M SBL 1 1 32 M SMT 1 C11H23 M SBV 1 32 -4.7149 4.5581 M END $$$$