MMs01138956 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 1.2977 -0.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8957 -0.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5926 -3.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2949 -2.2524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5899 -4.5047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2895 -5.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 -6.7524 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2867 -7.9524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5844 -7.5047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 -6.7571 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8848 -7.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8875 -5.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1825 -7.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0137 -7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1907 -3.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4911 -2.2618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4938 -0.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7887 -3.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -4.5142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0891 -2.2666 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3868 -3.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3841 -4.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6818 -5.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9822 -4.5237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9849 -3.0237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6872 -2.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2853 -2.2761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5830 -3.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6019 1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0381 0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6019 -1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8811 -4.1240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1073 -5.4586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0938 -4.6937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0689 -5.4676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5806 -8.5476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2206 -8.1114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7844 -6.4713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6118 -6.4597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -8.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5844 -8.5403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8042 -3.4684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9603 -3.9301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6752 -0.9724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9063 0.3650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4265 0.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9692 0.9084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0913 -1.0666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3438 -5.1170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6796 -6.4713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0203 -5.1256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6894 -1.0713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9811 -4.0666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6211 -3.6303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1849 -1.9903 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 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 52 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 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END