IBS-ZINC04090860 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 0.1090 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -0.5160 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -1.9060 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -2.6650 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0150 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -4.0280 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 -4.0780 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 -2.7900 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 -2.5490 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 -5.3050 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -6.3920 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -5.2120 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -5.6200 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -6.7710 1.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -7.3060 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -6.8330 3.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -8.4550 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -8.9910 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -10.1460 3.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -10.6910 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -11.7730 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -12.3250 3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 -11.7880 4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -10.7000 4.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -12.3320 6.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -11.7310 7.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -13.3920 3.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 1.1880 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 0.0730 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -2.5910 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -6.0460 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -4.9440 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -4.7860 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -5.8880 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -7.1480 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -8.8740 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -8.5720 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -10.2640 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -12.1930 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -10.2800 5.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -12.2600 8.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -10.6860 7.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -11.7880 7.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4650 -13.1540 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3860 -5.2270 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8740 -6.0610 0.0400 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 51 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 51 52 1 0 0 0 0 M END