IBS-ZINC04981535 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 1.8880 -0.4610 1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -1.2280 1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -0.8720 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -0.7670 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 0.2610 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 1.6320 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 2.2110 3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 3.5510 3.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 3.8530 2.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2670 3.5660 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 5.3950 2.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0020 5.8300 2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 4.6740 3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 4.7650 3.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 6.9550 2.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 5.8960 3.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 5.8480 5.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5910 6.3810 3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9170 7.2280 2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2380 7.6480 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2280 7.2280 3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9000 6.3910 4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5750 5.9760 4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7700 5.9110 5.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1310 6.3020 5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 3.0670 3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 2.6360 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 1.9360 3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4310 1.6850 4.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3920 2.0830 5.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 2.7740 4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -1.1610 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 0.1900 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 0.1580 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -1.8440 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -1.8780 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -0.3190 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -1.9100 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 0.2770 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -1.3230 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -1.1740 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 0.3410 3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -0.4800 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 2.3110 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 1.5720 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 1.5550 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 2.2860 4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 5.7530 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1650 7.5940 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 8.3120 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2430 7.5780 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3210 5.3250 5.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6860 5.8370 6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2410 7.3870 5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5640 5.9420 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 2.8460 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3920 1.5980 2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2090 1.1420 5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 3.1020 5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -0.2630 1.0760 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0350 0.5430 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 60 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 60 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 2 0 0 0 0 16 17 2 0 0 0 0 16 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 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END