IBS-ZINC04863231 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.1630 1.2290 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.2630 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -1.1010 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -0.5950 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -1.4560 3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -2.8330 3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -3.3530 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.4980 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -2.9620 0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.1290 -0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -0.8130 -0.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -2.6440 -2.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -3.9760 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -4.7950 -1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -6.0620 -1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -6.4440 -2.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -7.0240 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -8.3120 -0.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -9.3020 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -10.5770 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -11.5820 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -11.3170 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -10.0460 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -9.0370 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -12.5810 3.0120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -4.4630 -3.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -0.9680 5.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.9180 6.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 1.6860 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 1.6330 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.4480 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 0.4670 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -3.4940 4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -4.4190 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -2.0590 -2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -6.6640 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -7.0970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -10.7850 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -12.5750 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -9.8400 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -8.0440 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -3.9060 -4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -5.3680 -3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -2.4560 6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -1.3970 7.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -2.6240 6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END