MMs01788218 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 1.1311 -0.9852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5498 -0.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6809 -1.4836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0997 -0.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3874 0.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2563 1.4607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8376 0.9738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8062 0.9624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9372 -0.0229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3560 0.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6437 1.9362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4871 -0.5212 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4478 -1.1212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3548 -2.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7350 -2.6029 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7202 -1.4718 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3202 -2.5110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9490 -0.1853 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9342 0.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5983 2.4077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3144 0.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1821 -1.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4099 -1.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7701 -1.3650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9023 0.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6745 0.9908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8067 2.4850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1668 3.1175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2624 0.7617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4903 -0.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7882 0.9048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9048 0.7882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7882 -0.9048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4507 -2.6613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0045 -1.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4865 2.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9327 1.7620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2255 2.0125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7395 1.7166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7070 -1.2006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1771 -1.7852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0028 -3.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3041 -3.1928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7523 -2.0543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6729 2.0294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2549 3.6235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6608 4.2056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8010 -1.0822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4726 -0.7892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1796 0.8824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 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 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 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 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 M END