MMs03131709 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 59 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 1.2962 0.7549 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8942 0.7648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0197 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2353 -0.5803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4923 0.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4866 2.2746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7828 3.0295 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8220 3.6295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7771 4.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4752 5.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1790 4.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8772 5.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8715 6.7647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1677 7.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4695 6.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0847 2.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0904 0.7845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3809 3.0394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6827 2.2943 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6827 3.4943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6884 0.7943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9960 -1.4507 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2979 -2.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9789 3.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9732 4.5492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2018 -1.4803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9056 -2.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9113 -3.7352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0369 -0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8302 -0.9123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3729 -0.9065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1194 1.6811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6621 1.6869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4451 2.8707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9597 4.3256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1832 5.6587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1836 3.3197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8402 4.6608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 7.3608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1631 8.7196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5065 7.3785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3763 4.2394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5059 0.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2823 -0.3348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3964 1.1785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1728 -0.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7018 -3.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3393 -2.7918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8939 -1.1543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2433 -2.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -1.6391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2808 2.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3177 2.9081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 58 59 1 0 0 0 0 M END