MMs00164923 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 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 1.2951 -0.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0136 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 -1.2136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6059 1.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8931 -0.7704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2039 1.4727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 -0.7840 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4519 -1.3840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4833 -2.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 1.4591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1049 2.2023 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 1.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 -0.7977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0813 -2.2976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8163 -0.5255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7043 0.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8290 1.9015 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2043 0.6755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9475 -0.6274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9611 1.9706 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4611 1.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2179 3.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7179 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4610 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7042 0.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2043 0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2723 -1.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6054 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 0.6054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6054 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5189 -1.6720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0616 -1.6801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8059 1.4801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6122 2.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4059 1.4926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2833 -2.2777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 -3.4840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6833 -2.2903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7659 2.0646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3666 3.0130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6233 4.3002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3233 4.2861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6610 1.9407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2988 -0.3904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5988 -0.3763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1291 -2.3193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6372 -3.0977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4155 -1.5896 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 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 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 11 1 0 0 0 0 9 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END