MMs01439257 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 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 0.7393 -1.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2392 -1.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2606 1.2805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7607 1.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0213 2.5733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5213 2.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2605 1.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0371 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8998 -1.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2391 -1.3423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7391 -1.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4997 -0.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4783 -2.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9783 -2.6722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7176 -3.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9569 -5.2701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2175 -3.9897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9782 -2.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4781 -2.7092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2174 -4.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4567 -5.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9568 -5.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7174 -4.0268 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.7050 -5.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7297 -2.5268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2173 -4.0391 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1089 -2.8329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5317 -3.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5193 -4.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0889 -5.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1307 -2.3394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8306 -2.3617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1693 2.3370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8971 2.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2394 3.7533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3226 3.7444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6522 2.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1861 2.0195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1734 0.4768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6306 -2.3765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3474 -3.0609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6770 -3.8432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3868 -1.6527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0867 -1.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0481 -6.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3482 -6.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0747 -2.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6060 -1.7407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7908 -2.1365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7240 -3.4434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7137 -4.6925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7591 -5.9839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0448 -5.8513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5680 -6.3601 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 10 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 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 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 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 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 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 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 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 M END