MMs01380649 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 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 1.2996 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5969 1.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2973 2.2510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0012 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3008 2.2490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5993 1.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8989 2.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1962 -0.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4946 -0.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7954 1.4939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4970 2.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0927 -0.7571 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.8437 0.5413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3417 -2.0556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3911 -1.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5468 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0137 -3.3131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7647 -2.0146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7619 -0.8991 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -14.2567 -1.8590 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.0231 1.9667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9057 0.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -0.4604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0388 -0.6008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3006 -1.9490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2963 3.4510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3017 3.4490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1283 3.1668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6709 3.1656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7848 -1.1314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0145 0.2052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7225 -1.6737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2652 -1.6749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9770 1.2846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2067 2.6212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2690 3.1636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7263 3.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6543 -3.8023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5010 -4.4097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7969 1.5575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7982 -0.0484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1973 1.4959 0.0000 N 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END