MMs00239519 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 -0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2397 -1.3167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0397 -1.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4795 -2.6098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2192 -3.9147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7191 -3.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4794 -2.6335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7396 -1.3286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 1.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7600 1.2457 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 1.2339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1321 0.0135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5623 0.4657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5741 1.9657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1512 2.4404 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6990 3.8706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 4.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2218 3.0873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 5.6243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7945 2.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6495 4.3307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8700 5.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2354 4.5819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3804 3.0889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1600 2.2169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4559 5.4540 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0095 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3009 1.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6308 0.3897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5663 -1.8313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5541 -3.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0884 -4.3163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4182 -5.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5014 -5.1067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8435 -4.3459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3925 -3.4121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4047 -1.8694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7821 -1.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1242 -0.4666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5275 -0.2473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8886 4.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7503 5.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0751 4.5047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 3.8973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4118 2.2019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1072 2.2773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9261 5.9861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4202 6.7684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6378 5.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5572 4.8274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7540 6.3972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4728 2.5922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2760 1.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 M END