MMs01138659 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.2962 0.7549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2906 2.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5868 3.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8886 2.2647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5811 4.5098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3643 5.3869 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5157 6.2354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8224 6.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3224 6.8208 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7913 5.3960 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6398 6.2445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2196 4.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5370 3.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9653 3.0137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0763 4.0215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7589 5.4876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3306 5.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8698 6.4955 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0606 4.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3669 3.4496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 5.9175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6039 5.4486 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6431 4.8486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9102 3.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7224 6.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1472 5.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2657 6.9786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9593 8.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5345 8.9159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 7.9164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 -1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7109 -0.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4772 0.9677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1096 2.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8759 3.3810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6477 7.0602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9434 8.0091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6483 2.6655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2193 1.8408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2189 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0766 7.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 7.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0849 4.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1553 2.8055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7355 3.7351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3923 4.8044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4055 6.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8541 9.2466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2894 10.0906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2762 8.2915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 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 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 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 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 M END