MDPI-ZINC03843986 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.0020 1.4800 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0440 0.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7000 -0.5790 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.1510 1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -0.6480 0.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8790 -1.7390 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -0.1080 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.5770 -1.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7600 -1.6780 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -0.1900 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -0.7240 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -0.1240 -1.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9810 0.9750 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -0.5930 0.1100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3000 -1.6840 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -0.2220 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -1.0530 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -1.4370 -0.0760 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5720 -0.3820 -1.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0700 0.5800 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 -0.9290 -2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 -1.5060 -1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -1.5490 -0.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2690 -0.3900 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7360 -0.5620 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6090 -0.5660 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -2.8000 0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -2.8210 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 -0.1970 0.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.8470 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.8590 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8220 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.1920 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -1.6690 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.9310 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -0.5890 2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 0.9760 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -0.5060 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 0.8900 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -0.6310 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -0.4200 -3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -1.8090 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -0.4210 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 0.8390 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -1.9690 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -0.4870 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -0.1170 -3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -1.7010 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 -0.8560 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7310 -2.5100 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -0.3740 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 0.5480 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0680 -0.6810 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6600 -0.6890 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2770 -0.4460 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9200 -2.9360 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -3.5350 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -3.1530 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -2.7550 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -0.5070 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 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 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 28 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 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 M END