MDPI-ZINC04264923 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -0.0500 1.5860 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 0.0570 0.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3960 -0.2720 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.5120 1.3420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7180 -0.1270 1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.2330 2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -1.5890 3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -2.3900 2.7360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9780 -1.9320 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.0560 1.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8090 -2.6260 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -4.0820 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -4.6760 1.7220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1560 -4.7290 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -3.8590 3.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0160 -4.0380 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -4.3750 3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -5.8460 4.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -6.2940 3.5900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3260 -5.6750 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -6.1290 2.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8660 -6.5040 1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 -7.9420 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -8.1200 3.4050 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9570 -7.4810 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -7.7440 3.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -9.4850 3.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -7.0280 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -2.4860 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -0.4050 0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 1.9380 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.9920 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.9150 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 0.5010 3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 0.1180 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -1.4350 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -2.0610 3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -2.5720 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -2.0210 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -4.6840 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -4.1260 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -3.7920 4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -4.2980 3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -5.9400 5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -6.4630 3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -6.4140 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -5.8300 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -8.6430 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -8.1600 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -7.8300 5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -8.4180 3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 -9.7920 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -6.8890 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -8.0700 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -6.7630 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -2.1820 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -3.5690 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -2.0130 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -0.0820 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 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 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 M END