MMs01077947 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 0.8194 -1.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -2.0758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6388 -2.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0758 -0.4370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9944 1.0607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4136 -1.1155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -0.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5887 1.2017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8451 2.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1829 1.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2643 -0.1551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0079 -0.9745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6021 -0.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6835 -2.3313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8586 -0.0141 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1964 -0.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2778 -2.1903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6156 -2.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8720 -2.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7906 -0.5516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4528 0.1268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3714 1.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6278 2.4440 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.6970 -4.3665 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0051 0.6555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6555 1.0051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5026 -0.3278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7648 -1.5732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4422 -2.7313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1093 -2.5784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1362 -2.8406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2943 -3.5180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6439 -1.8574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4787 -2.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5184 1.7444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 3.2193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1881 1.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -2.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7934 1.1841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2726 -2.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9423 -2.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7958 0.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0336 2.3030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 2 0 0 0 0 M CHG 1 24 -1 M END