MDPI-ZINC03845692 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -2.5870 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 -4.1110 -0.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2740 -4.3910 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -4.7240 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -4.6300 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -6.1380 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6810 -6.6560 -0.7320 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2120 -6.0910 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6600 -8.1150 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 -8.4890 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 -9.8270 -2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6200 -10.7920 -1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 -10.4190 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -9.0800 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3470 -6.4980 0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -2.3100 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -2.1560 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -4.3550 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -4.4440 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -5.8100 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 -4.4280 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 -4.1270 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -6.3390 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -6.6410 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8710 -7.7350 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -10.1190 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 -11.8380 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 -11.1720 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -8.7880 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 -6.9740 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 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 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 M END