MDPI-ZINC03843661 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 0.0310 1.3430 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.1810 -0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7550 -0.7070 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -0.5420 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -1.2820 -0.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3240 -2.3310 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -0.7580 -1.6120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0990 -1.4150 -2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -0.8740 -1.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1610 -1.9670 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -0.3170 -2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -0.3610 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -0.5410 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6780 -1.5660 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 0.4350 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 0.0420 0.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 1.2880 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 2.1920 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 1.7560 0.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 0.4310 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 0.6520 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 0.5960 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -0.2730 -1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 -1.3270 -0.7000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4900 -2.6980 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2420 -2.5220 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4830 -1.6500 -2.4360 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0150 -1.5900 -3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -0.2400 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 -2.2290 -1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 -1.1680 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 1.6550 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7020 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 1.7610 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -0.1520 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -1.7650 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 0.5110 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -0.9670 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 0.6950 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -0.9720 -3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 0.5720 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 -1.2030 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 1.1600 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 1.6860 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 2.0240 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 3.2420 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 0.8940 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 0.9920 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -0.5960 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 1.0380 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 1.3240 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 1.3000 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -3.2410 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -3.2540 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -3.5030 -2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 -2.0640 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 0.4650 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 0.0700 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1570 -1.7240 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -1.9780 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -1.2030 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 -0.2120 1.0560 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 9 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 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 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 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 52 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 M END