MMs01137390 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 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 1.3038 -0.7418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9018 -0.7253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4998 -0.7089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5093 -2.2088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0494 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0978 -0.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1073 -2.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4111 -2.9341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7054 -2.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6959 -0.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2939 -0.6595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9806 1.5822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2749 2.3404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2654 3.8404 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.3046 3.2404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0463 4.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5008 6.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0008 6.1534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4733 4.7297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0091 -2.9177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0186 -4.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3224 -5.1594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6166 -4.4012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6071 -2.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3034 -2.1595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5934 1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5934 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5383 -1.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0809 -1.6561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8209 0.9308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3635 0.9406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1363 -1.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6789 -1.6397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4189 0.9473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9616 0.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7865 1.2493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 -2.7989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4187 -4.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3845 1.2658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9376 2.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6924 1.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4553 2.5563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4529 3.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9470 5.1955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3255 6.3859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6187 7.3381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8678 7.3460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1729 6.4103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8355 -4.2168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6153 -5.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5569 -6.0835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0995 -6.0738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0342 -5.5262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7971 -4.1854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7902 -3.1021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0104 -1.7710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5262 -1.2451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0689 -1.2354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 M END