MMs00408608 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4999 0.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2609 -1.2799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7609 -1.2672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7608 -1.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0218 -2.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5218 -2.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7829 -3.8652 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.2607 -1.2291 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2480 0.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2734 -2.7291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7607 -1.2164 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5216 -2.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0216 -2.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7605 -1.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9996 0.1016 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.1996 0.1016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 0.0889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7385 1.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9776 2.6996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2385 1.4197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9775 2.7250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.5775 1.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2165 4.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4774 2.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2164 4.0431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7163 4.0558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0102 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2816 1.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6241 0.4327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8911 1.0722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 1.0951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6306 -3.5813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3975 -2.9290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7400 -3.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8232 -3.6798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1526 -2.8972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6863 -1.9545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6732 -0.4119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3686 0.4898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6980 1.2724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8473 0.3856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2506 4.6264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6077 5.0518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1824 3.4089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2790 1.5542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6085 2.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7265 2.8558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9163 4.0659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7062 5.2557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END