MMs02728322 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 63 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 1.2931 0.7602 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2539 1.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8911 0.7806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8793 2.2805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5744 3.0203 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5352 3.6203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2813 2.2601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5627 4.5203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2078 -1.4592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4891 0.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -1.4293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4321 -1.7296 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1719 -0.4248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1595 0.6820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6624 -0.2563 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5536 -1.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9542 -2.8379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0441 -1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9353 -2.5009 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3359 -3.8760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5044 -5.3665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1294 -4.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4258 -2.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3169 -3.5390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0251 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5156 -0.7888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1149 0.5862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2237 1.7928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7332 1.6243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1339 0.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8231 3.1679 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6081 1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0345 -0.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6081 -1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8339 -0.9049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3765 -0.8928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0627 2.0814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2809 3.4113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7626 4.5297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5532 5.7202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3627 4.5108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7106 1.7141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2532 1.7263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0770 -2.2392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1419 0.8438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7043 -0.1434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1185 -0.7598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4950 -4.1865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7021 -5.4408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2233 -6.5331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2596 -3.9403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4662 -5.7672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2285 -1.7541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3073 0.7210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0203 2.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9415 0.1144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 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 46 1 0 0 0 0 13 47 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 15 48 1 0 0 0 0 16 17 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 49 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 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 M END