IBS-ZINC05046830 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -0.8560 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -1.3430 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -1.6350 -2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -1.4920 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -1.1820 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -0.6960 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -0.3780 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -0.5460 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -1.0330 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -1.3420 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 -1.8660 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -3.8960 2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8080 -5.4240 2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -5.2900 3.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 -3.7620 3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2790 -7.3200 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 -1.1950 4.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -0.1530 5.1770 Cl 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -0.7460 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -0.0020 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -1.4520 3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 -1.5730 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2380 -3.5730 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 -3.5500 3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8010 -5.8440 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1350 -5.7710 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -5.6360 3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -5.6130 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -3.4150 4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -3.3420 3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 -7.7290 2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2900 -7.7060 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8980 -7.6110 4.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 -0.4160 5.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 -3.3320 2.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2990 -5.8540 3.5890 N 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 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 43 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 44 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 43 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 44 1 0 0 0 0 20 42 1 0 0 0 0 M END