IBS-ZINC02421769 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 -0.0440 1.8120 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 0.2880 -0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9360 -0.1440 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.1070 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 0.5530 1.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -0.2140 -1.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.4550 -2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -0.9380 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -1.1640 -4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -1.6640 -5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.0000 -7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.4460 -8.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 -2.5680 -7.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -1.8050 -5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -1.3290 -3.8860 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -3.0270 -8.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -2.0190 -8.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8320 -2.6870 -8.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5190 -4.2000 -8.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -4.2730 -8.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -2.8050 -9.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -2.9720 -9.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -1.8640 -9.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -1.8580 -7.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -0.5580 -9.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -2.0120 -9.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -0.9110 -4.6700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -0.4630 -3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -0.2400 -2.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 2.2440 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 2.0930 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 2.1850 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 0.1880 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -1.1860 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 0.3490 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -0.3780 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -1.6990 -9.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -1.1620 -8.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5900 -2.3780 -9.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 -2.4570 -7.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5610 -4.5060 -9.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 -4.8000 -8.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 -4.3120 -7.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 -5.1420 -8.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -2.0100 -10.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -3.7350 -9.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -2.6900 -7.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -0.9200 -7.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -0.5730 -10.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 0.2830 -9.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -0.4540 -9.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -2.9400 -8.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -1.1680 -8.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -2.0350 -10.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -0.2730 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -2.2530 -6.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 29 2 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 16 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 56 2 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 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 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 M END