MMs01337567 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 -0.7426 -1.3033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0149 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5148 -2.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2574 -1.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7264 -1.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -3.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5249 -3.6984 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2821 -4.8736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8353 -0.5796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2645 -1.0349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3735 -0.0249 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8027 -0.4803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1230 -1.9457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9117 0.5298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5914 1.9952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7004 3.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1296 2.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4498 1.0845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3409 0.0744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8791 0.6291 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.4237 -0.8001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3344 2.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3083 0.1738 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5177 -1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8106 -2.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2116 -1.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6670 -0.1072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8332 1.1393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3384 1.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2386 3.5600 0.0000 Cl 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 -1.9425 -1.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5792 -3.6407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 1.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9343 -3.6745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 0.1538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3926 0.4832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7072 -2.0977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2144 -1.7683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1173 1.1474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4481 2.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4442 4.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5971 -1.0979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3220 -1.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1541 -2.4551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9870 -2.9450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4780 -3.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3799 -2.7246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4074 -1.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7007 -0.7167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4911 0.7650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9540 1.5679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6646 2.3274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3045 1.8733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7020 2.4077 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END