MDPI-ZINC03846419 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.5420 1.7190 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 0.2000 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -0.2930 -1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -1.8130 -1.4650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8680 -2.4720 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.1750 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -2.8870 0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -1.6500 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.2980 -2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -1.5100 -3.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -3.6070 -2.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -4.0020 -4.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8190 -3.1920 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -4.3090 -5.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -5.4470 -4.7030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5000 -5.6660 -5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -6.6960 -4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -6.3890 -3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -5.2500 -3.7970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5290 -5.5480 -4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -4.9440 -2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 -6.1920 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 -3.8060 -3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -5.0300 -3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 2.1880 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 1.9810 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 2.0700 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -0.0630 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.2700 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -0.0310 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 0.1760 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -2.2100 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -3.5540 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.1200 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -0.6950 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -2.3630 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 -1.5100 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.4200 -5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -4.6060 -6.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -7.5060 -4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -6.9930 -5.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -6.0920 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -7.2780 -3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -4.6460 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 -5.9730 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 -7.0020 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -6.4890 -3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -2.9160 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 -3.5870 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -4.1020 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -4.0390 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -5.7470 -3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -5.0080 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 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 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 M END