MMs02086774 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 51 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 1.3031 -0.7429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 -0.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1879 1.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8847 2.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5898 1.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4828 2.2855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7859 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0808 2.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3839 1.5569 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3839 2.7569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6788 2.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6706 3.8140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6953 -0.6860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7035 -2.1860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0066 -2.9288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7199 -5.1859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3179 -5.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5943 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 0.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5943 -1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5368 -1.6663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0795 -1.6579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 -1.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2386 -0.5659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8782 3.4713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5473 2.1085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4762 3.4855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3044 3.2148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8471 3.2232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8782 -0.8879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0995 0.4439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5206 -1.9841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2992 -3.3158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4109 -1.7990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1895 -3.1307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1142 -4.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6840 -5.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3256 -6.2218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7236 -6.2142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3604 -5.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9123 -4.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9820 1.5711 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.3921 0.0569 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.2093 0.2588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9879 -1.0730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0148 -4.4288 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.0148 -5.6288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 47 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 50 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 50 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 50 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 46 -1 M CHG 1 47 1 M CHG 1 50 1 M END