MMs01685912 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 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 -1.5000 0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2477 1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4953 2.6008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0047 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7523 1.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 3.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 3.8931 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0093 5.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2617 6.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 7.7888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 7.7861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2617 6.4857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5093 5.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 3.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5047 2.5900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 3.8850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5093 5.1826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0093 5.1799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7570 3.8796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0047 2.5819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5047 2.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7523 1.2869 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.2664 9.0838 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 3.9012 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4906 5.1988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 3.9039 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5981 -1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1019 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4477 1.3052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9523 1.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8551 2.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0617 6.4933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4159 8.8291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4617 6.4836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9112 6.2230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6112 6.2181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9570 3.8774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6028 1.5416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END