MMs00332825 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 1.3006 0.7473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8987 0.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9017 2.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6043 2.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3037 2.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6073 4.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2023 2.9893 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4998 2.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4967 0.7366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8004 2.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0979 2.2312 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0948 0.7313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3985 2.9786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6960 2.2259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6929 0.7259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9965 2.9732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2940 2.2205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5946 2.9679 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.5554 3.5679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8921 2.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8890 0.7152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1865 -0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4871 0.7098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4902 2.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1927 2.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1958 4.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8983 5.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5977 4.4679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5979 1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0405 -0.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5979 -1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5956 -1.2054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9366 0.1398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2657 2.8495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8073 4.4922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6098 5.6946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4073 4.4971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2048 4.1893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0309 3.9048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5736 3.9016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6290 3.8994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1717 3.8962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9990 4.1732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5208 1.3029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0635 1.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8485 0.1173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1840 -1.2375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5251 0.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5306 2.8077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3771 4.2517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6085 5.5893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6715 6.1328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1288 6.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 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 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END