MDPI-ZINC03845083 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 0.0210 1.3890 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.1200 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -0.4900 0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5650 -2.0080 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -2.6960 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -4.2140 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -4.6330 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -3.9450 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -2.4270 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 0.1890 1.4350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0140 -0.1210 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -0.2080 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 -1.0720 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 -1.4380 3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -0.9390 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 -0.0730 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 0.2950 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 -1.2980 3.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0060 -0.7450 2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 1.6080 1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -0.0540 -0.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 1.6300 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 1.6970 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 1.9150 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.6500 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -0.4000 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -2.3000 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -2.4040 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -2.3980 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -4.7040 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -4.5060 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -4.3410 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -5.7140 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -4.2440 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -4.2370 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -1.9370 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 -2.1350 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -1.4600 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -2.1120 4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 0.3170 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 0.9720 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9320 -1.1120 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 0.3420 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9600 -1.0440 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 1.9550 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -0.2560 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 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 20 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 M END