MDPI-ZINC03847555 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 84 0 0 1 0 0 0 0 0999 V2000 -1.1080 -0.5030 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -2.0010 -2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -2.3840 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -1.7610 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -2.0320 0.1180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5630 -3.4620 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -3.7950 1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 -3.6050 0.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0110 -2.2010 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -1.2070 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9940 -1.2770 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 -2.4770 2.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1960 -2.2640 2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5730 -3.8060 1.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7840 -4.1850 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1410 -4.2800 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5210 -2.9960 1.8810 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5640 -2.2270 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3800 -2.5410 2.8650 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7760 -1.1360 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1710 -1.0830 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2520 -1.5570 3.0760 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.3120 -0.8210 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9870 -2.9710 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2760 -4.0810 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0080 -3.1900 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4950 -1.5030 3.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2090 -1.5440 3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2090 -3.4620 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3410 -4.9990 2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -1.7910 -0.8460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7510 -0.7100 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -2.3780 -2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -4.6930 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 -0.9680 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 0.1940 0.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -2.7990 -4.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.2480 -3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -0.2390 -3.9590 H 0 0 0 0 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-1.3700 2.3840 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 27 28 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 29 68 1 0 0 0 0 30 69 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 34 74 1 0 0 0 0 34 75 1 0 0 0 0 34 76 1 0 0 0 0 35 36 2 0 0 0 0 35 80 1 0 0 0 0 37 77 1 0 0 0 0 37 78 1 0 0 0 0 37 79 1 0 0 0 0 M CHG 1 80 -1 M END