MMs01366469 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 65 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 0.0045 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0437 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2923 -2.2539 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3316 -2.8539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5936 -1.5077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8904 -2.2616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1917 -1.5155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4885 -2.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4840 -3.7693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7897 -1.5232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9510 -0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9506 1.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4184 2.5110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8865 2.8185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8869 1.7008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4191 0.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1652 -1.0257 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1582 -2.1374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4657 -3.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 -4.6059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6555 -6.0740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0807 -6.5418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1984 -5.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8909 -4.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6565 -1.1869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2879 -3.7539 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0134 -4.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7595 -3.1987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7327 -5.8012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3147 -5.2461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6115 -4.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9127 -5.2384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9172 -6.7384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6204 -7.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3191 -6.7461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2185 -7.4845 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3057 -2.2461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0036 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4231 -0.5939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9657 -0.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7761 0.8398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6181 3.4052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2607 3.9587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0614 1.9468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2079 -4.2317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7614 -6.8743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3267 -7.7163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3386 -5.9157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7851 -3.2730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7855 0.0062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8496 -1.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5276 -2.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3253 -4.3569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6079 -3.2923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9502 -4.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -8.6922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2817 -7.3492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3432 -1.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 28 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 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 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 20 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 37 61 1 0 0 0 0 39 62 1 0 0 0 0 M END