MMs01486552 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.2956 0.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8937 0.7675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8869 2.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 2.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0898 0.7909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4628 0.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7813 -1.2788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4615 1.3062 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0778 -0.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5703 -0.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4465 1.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8302 2.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3377 2.5237 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9377 3.5629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7215 3.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7057 2.6019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2399 2.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1207 3.2821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6047 1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0365 -0.6047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6047 -1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5202 1.6716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0628 1.6786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6035 -1.1883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2015 -1.1766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0269 -0.8876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5696 -0.8807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9147 -0.3569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1669 -1.2580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2447 -1.3664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6512 -0.7326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2839 0.1466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4383 1.6816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9932 2.6692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7411 3.5703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8155 4.3843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2284 4.9853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6274 3.3982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1888 3.7003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 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 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 M END