MMs02528588 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 66 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 0.2288 -1.4825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8361 -2.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1605 -3.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -3.6493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1672 -4.5012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5625 -2.1688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9018 -1.4931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1565 -2.3150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9862 0.0045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3254 0.6802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8467 -5.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3167 -2.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2653 -3.4603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7629 -3.3758 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9629 -3.3758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 -4.7741 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1441 -5.7227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2286 -7.2203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8828 -4.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4846 -5.4538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7565 -5.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1505 -6.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9949 -8.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4453 -8.8161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5017 -7.7512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1077 -6.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6573 -5.9214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5749 -2.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8886 -0.7808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7005 0.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1988 0.4079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8851 -0.9259 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0731 -2.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8487 -0.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 0.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 1.1860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -0.3912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3968 1.2207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7849 1.7516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9138 -4.6628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1213 -5.7454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2203 -5.7609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8563 -3.9607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9515 -5.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9555 -6.7132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0506 -7.7997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8950 -9.6295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7999 -8.5430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9425 -9.9057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4310 -9.5005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3027 -6.1946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2076 -5.1081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1601 -4.8319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6716 -5.2371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -0.7228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1515 1.5475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8483 1.4169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6222 -3.2542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3931 -6.0468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6009 -6.9863 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.7524 -7.8348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 35 2 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 34 60 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END