MMs00978528 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.3020 0.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3079 2.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5921 -1.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8882 -2.2654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1902 -1.5205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 0.7346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4863 -2.2756 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7882 -1.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0843 -2.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3863 -1.5410 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6824 -2.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6764 -3.7961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9725 -4.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9666 -6.0513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2745 -3.8064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2804 -2.3064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9844 -1.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2923 0.6936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5824 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8903 0.6833 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.5706 -4.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5959 1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0416 -0.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5959 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2628 1.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5079 2.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3127 3.4448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1079 2.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5505 -2.1061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8835 -3.4654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2377 0.5754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9048 1.9346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4815 -3.4756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3093 -3.2021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8520 -3.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6349 -4.3920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9534 0.5528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2970 1.8936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6193 -2.1657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9665 -5.5984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6074 -5.1656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1747 -3.5247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 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 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END