MDPI-ZINC04235332 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 75 0 0 0 0 0 0 0 0999 V2000 1.7940 3.3490 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 1.8260 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 1.3170 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 1.3590 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 0.7860 1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 0.1730 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 0.1250 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 0.7010 -0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 0.7850 -2.1620 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5340 1.4060 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 1.6410 -3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 0.5830 -4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -0.7300 -4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -1.6260 -4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 -2.9490 -4.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -3.8090 -5.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -3.5940 -6.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -4.3650 -7.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 -4.2400 -8.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 -5.3390 -9.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 -5.7420 -10.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1390 -6.8060 -10.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 -7.4590 -9.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 -7.0570 -7.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 -5.9870 -7.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 -5.4030 -6.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -5.8490 -5.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9010 -7.3180 -11.8060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -4.4610 -9.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 -2.8720 -9.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -3.4310 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -2.6340 -2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -1.1420 -2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 -1.1050 -6.3680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 0.2310 -3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 0.8380 3.6820 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 1.1650 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 3.8010 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.6970 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 3.6330 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 1.8390 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8790 -0.2720 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -0.3560 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 2.6510 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 0.7670 -5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -4.6560 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -2.8130 -7.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 -5.2300 -11.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1080 -8.2890 -9.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 -7.5720 -7.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -6.1430 -5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -6.7000 -5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 -5.0350 -4.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -3.7150 -9.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -4.3680 -10.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 -5.4580 -9.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2050 -2.7520 -8.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 -2.8000 -10.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 -2.0880 -8.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -4.4900 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -3.2850 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -2.8130 -3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.9460 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -0.9600 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -0.5630 -2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 0.3440 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 -0.8270 -3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 0.7630 -4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 1.4950 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 0.0820 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 1.4470 0.0540 H 0 0 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 10 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 M CHG 1 9 1 M END