MMs01085555 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 -1.5000 0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5147 -2.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0147 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7426 -1.3033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -3.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5294 -5.1876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -3.8758 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1720 -2.8366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5293 -5.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7867 -6.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2867 -6.4823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5146 -2.5726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0146 -2.5641 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8894 -1.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4178 0.0784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3186 -1.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6134 -1.0437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9166 -1.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9251 -3.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6303 -4.0436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3271 -3.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9031 -3.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4477 -5.2018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6059 1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0941 1.0511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4573 -1.2795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5794 -3.6406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9426 -1.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4442 -4.3941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 -5.9367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3847 -2.1685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7163 -1.3896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6066 0.1563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9524 -1.1804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9677 -3.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6371 -5.2436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5441 -7.7686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9499 -8.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 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 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 39 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 24 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 39 40 1 0 0 0 0 M END