IBS-ZINC05343722 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 3.8780 -3.8280 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -3.5060 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9790 -2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -2.1850 -3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -2.1820 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -1.9030 -1.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6690 -0.8230 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -2.4320 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -1.7770 0.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -2.1330 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 -1.5830 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -2.0080 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 -2.6850 3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 -3.0620 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9570 -2.7610 3.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2390 -2.0740 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 -1.6890 1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5440 -0.9450 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7250 -0.9600 0.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4990 -0.3200 -0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -0.5200 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 0.1110 -0.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 0.5680 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 0.6690 -2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 1.5290 -3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5270 2.3080 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 2.2240 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0080 1.3620 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -4.3440 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -2.9200 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -4.4870 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -4.4000 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -3.0530 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -4.0520 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 -2.7800 -3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -1.1630 -3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -2.6410 -4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -1.4250 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -3.1610 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -3.5150 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -2.2400 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -0.9360 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -2.9550 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -2.9210 3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -3.5860 4.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 -3.0540 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2750 -1.8350 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 0.0580 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 1.5840 -4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7890 2.9780 -4.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2400 2.8320 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6640 1.3490 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -2.4980 -1.3480 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5610 -1.6960 -1.2820 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 32 1 0 0 0 0 2 33 1 0 0 0 0 2 53 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 3 53 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 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 53 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 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 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END