MMs01544849 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 0.7609 -1.2927 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4391 -1.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0219 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7828 -3.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2827 -3.8780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0218 -2.5727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2608 -1.2801 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6608 -0.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2607 -1.2548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2389 1.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7388 1.3558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6103 2.5767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1348 3.9993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0407 2.1252 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8714 3.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0774 4.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4528 3.9089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6222 2.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4161 1.5266 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4553 0.9266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5854 0.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0533 0.6252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6307 0.1497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1792 -1.2807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0341 0.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6087 1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0341 -0.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9039 -1.8344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8909 -3.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3414 -4.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0011 -5.0706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0843 -5.0615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4137 -4.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9475 -3.3363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9345 -1.7937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3912 1.0594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1078 1.7441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4373 2.5266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7207 3.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3363 4.6897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2072 5.3337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7401 5.5079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7333 5.0756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6506 3.8352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7729 2.7589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1573 1.3444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3931 -0.0993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7209 -1.1561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7778 0.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0300 -0.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 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 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 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 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 50 1 0 0 0 0 24 51 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 26 27 2 0 0 0 0 M END