IBS-ZINC04870528 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.0900 -0.0280 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 0.4990 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 2.0650 1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 2.6730 3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 4.1490 2.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 4.7310 3.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 5.3680 4.9880 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6680 6.2290 4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 5.8130 5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 5.4360 4.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 4.7720 3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 4.3290 2.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7880 5.6230 5.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 6.4610 6.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 6.6380 7.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 6.9580 7.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 6.6330 8.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 7.1020 9.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2080 7.8930 8.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8380 8.2180 7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6440 7.7620 6.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3780 8.3490 9.0440 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 4.3790 5.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 3.0680 5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 2.1580 6.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 2.5570 7.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 3.8710 7.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 4.7810 6.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 4.2660 7.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 3.2750 8.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -1.0750 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 0.4530 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 0.0380 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 0.9370 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.5600 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.0080 4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 2.1520 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 2.5980 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 2.1400 3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 2.5860 3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 4.6810 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 4.2350 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 7.1020 8.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 6.0170 9.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 6.8520 10.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4850 8.8340 6.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 8.0200 5.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 2.7540 5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 1.1350 6.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 1.8460 7.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 5.8040 6.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 3.7210 9.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 2.8860 9.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 2.4610 7.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 0.6480 2.2310 N 0 0 0 0 0 0 0 0 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 1 55 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 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 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END