IBS-ZINC01213818 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 64 0 0 1 0 0 0 0 0999 V2000 -0.5100 0.7170 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 0.4290 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 2.5660 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 2.9540 1.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7910 2.4730 2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 4.4730 1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 4.8260 2.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 6.1470 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 7.0860 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 8.4280 2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 8.8380 3.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 7.9060 4.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 6.5610 4.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 5.3910 5.3750 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 10.5520 4.3170 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 10.6250 5.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 11.1710 3.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 11.1960 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 11.1860 4.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9990 11.6900 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8520 12.2060 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 12.2150 1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 11.7140 2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 12.8600 -0.0940 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.9300 12.7020 1.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1850 12.6600 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2720 13.2570 1.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.2800 12.7370 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6350 13.1000 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9750 12.7590 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8960 13.9600 1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0040 14.6450 1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 2.5290 1.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -0.3670 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 1.0500 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 1.1790 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 0.6970 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -0.6500 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 0.7360 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 3.0480 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 2.8910 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 4.8080 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 4.9520 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 6.7660 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 9.1590 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 8.2280 5.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 10.7840 5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9710 11.6820 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 11.7240 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4360 11.6260 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1180 13.2370 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8350 12.0420 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6310 13.6280 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3190 11.8000 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0720 12.6100 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7520 13.1990 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6850 14.7470 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2240 13.0630 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6820 14.2920 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9820 15.1710 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 2.9190 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 1.1080 0.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.6800 13.6610 1.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 62 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 2 62 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 62 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 33 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 49 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 63 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 63 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 63 1 0 0 0 0 32 60 1 0 0 0 0 33 61 1 0 0 0 0 M END