IBS-ZINC04718773 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 -0.0760 2.2170 4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 1.0040 4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 0.2370 4.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 0.6880 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 1.9120 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 2.6700 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -0.1290 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -1.3420 2.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 0.4720 1.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -0.3190 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 0.1180 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6310 2.2890 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 1.9360 2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9900 2.0100 2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 3.4560 1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 4.0620 1.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 4.0750 1.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4620 5.4390 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0820 6.2950 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5960 5.8060 3.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1850 6.6650 4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2830 8.0240 4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7940 8.5310 3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1810 7.6750 2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6940 8.1440 1.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1150 7.3610 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9850 5.9950 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 5.3460 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4090 6.3690 -1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 7.7110 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 2.8120 4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 0.6570 5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -0.7100 4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 2.2670 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 3.6170 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -1.3780 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -0.1430 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 -0.1540 2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -0.3790 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 3.3640 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 1.9920 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 2.3250 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 2.3690 2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 1.3990 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 1.9010 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1030 3.5700 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 4.7540 3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5810 6.2880 5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7530 8.6860 5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8780 9.5880 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7940 4.4160 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2440 5.1580 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3060 6.1840 -2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5180 6.3490 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 8.1540 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 8.3960 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 1.5730 1.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 57 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 12 57 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 57 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 46 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 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 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END