MMs02597878 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 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 0.7439 -1.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2439 -1.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2438 -1.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4877 -2.6192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9878 -2.6121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7438 -1.3307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4877 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7316 -3.9288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9877 -2.6403 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3877 -1.6011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7438 -1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7316 -3.9429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2316 -3.9499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9877 -2.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4876 -2.6615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2315 -3.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4754 -5.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9755 -5.2525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7315 -3.9711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4754 -5.2736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4876 -2.6756 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.9876 -2.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7315 -3.9851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2315 -3.9922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9876 -2.6967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2437 -1.3941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7437 -1.3871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9998 -0.0846 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 0.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5951 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -0.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3857 -1.7077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9467 -2.4853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4049 1.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1048 1.0153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0829 -3.6612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3829 -3.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3487 -0.2943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7802 -1.9497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3487 -0.3084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7074 -0.7399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3926 -1.6124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0925 -1.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0706 -6.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3706 -6.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8925 -1.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1266 -5.0215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8266 -5.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.1876 -2.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8485 -0.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 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 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 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 14 1 0 0 0 0 12 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 M END