IBS-ZINC02345412 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -2.5400 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -2.7840 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -3.2400 4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -3.4450 4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -3.9210 5.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 -4.0050 5.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -4.4490 6.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -4.7700 7.3990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -4.6770 7.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -4.2690 6.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 -4.5490 5.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 -5.0120 6.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 -5.0300 6.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5920 -3.9440 6.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8310 -3.9710 5.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1770 -5.0940 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2820 -6.1430 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1120 -6.0850 5.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2120 -3.5070 3.5810 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -3.1790 3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -2.7420 2.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -3.4360 5.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -3.4630 5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -2.6380 3.9400 C 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -4.9470 8.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6440 -4.3130 4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 -4.3380 7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 -6.0180 7.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2890 -3.0840 6.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 -3.1360 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1350 -5.1500 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5440 -7.0220 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -4.3800 6.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -2.6060 6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -4.4850 4.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -2.9860 5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -1.5920 4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -3.0400 3.1280 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 25 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END