MMs00039608 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.2952 0.7567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2875 2.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5827 3.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 2.2700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8932 0.7700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6057 -1.4867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2038 -1.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5066 -2.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8018 -1.4600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4913 0.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9616 0.9818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6205 2.4425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4254 0.6544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5046 1.6963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8289 0.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5683 -0.4852 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.7274 -0.1747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0834 -0.6951 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6834 -1.7343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4399 -2.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3807 -3.2183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9789 -2.3898 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6101 -1.5644 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0656 -1.2016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4792 0.2402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1075 -2.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5630 -1.9180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6048 -2.9972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0603 -2.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4739 -1.1926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6053 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 -0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6053 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2452 2.8513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5765 4.2133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9217 2.8753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4057 -1.4928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6119 -2.6866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8057 -1.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1676 -2.0787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5128 -3.4166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4851 1.9833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5854 2.4677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1757 2.6911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2785 2.1045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9824 0.6610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 -3.5609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2793 -2.7178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1126 -2.9517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5955 -3.3771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6099 -3.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0928 -4.0935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1022 -3.7136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.2666 -3.4234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 46 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 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 34 2 0 0 0 0 33 57 1 0 0 0 0 57 58 1 0 0 0 0 M END