MMs02403819 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 62 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 -0.0032 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2942 -2.2528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -3.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0096 -4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5884 -4.5056 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5884 -3.3056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5852 -6.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2846 -6.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0128 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2814 -8.2528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8891 -3.7583 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1865 -4.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -6.0111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4871 -3.7639 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4871 -4.9639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -2.2639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 -1.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0884 -2.2695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3891 -1.5223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0949 0.7305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6929 0.7250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2910 0.7194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0334 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.6961 2.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9968 2.9722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0000 4.4722 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0026 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1845 -1.2891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4161 -2.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7674 -5.7997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9932 -7.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2454 -7.3528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5894 -4.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0508 -5.3978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6151 -7.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0814 -8.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2788 -9.4528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4814 -8.2553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8916 -2.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3081 -2.4698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0823 -1.1354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0859 -3.4695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4270 -2.1245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0974 1.9305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7563 0.5855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2170 -0.9454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7597 -0.9487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9063 1.1799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0643 1.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5139 2.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2881 3.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2008 2.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1790 3.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7820 -5.7167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7846 -4.5167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8251 -3.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 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 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 61 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 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 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 M END