IBS-ZINC02199444 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 57 0 0 1 0 0 0 0 0999 V2000 1.1430 0.6930 -0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -0.7170 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -1.7280 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -0.7310 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -2.1370 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -3.4170 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 -4.4640 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -5.7530 3.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6250 -5.6420 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -6.3400 3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -7.0040 1.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -7.3200 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -7.8490 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -8.7710 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -9.7530 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -10.5820 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 -10.4340 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 -9.4610 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 -8.6300 2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -2.5140 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -4.0010 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -4.2820 -2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -4.9290 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 0.7500 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 1.4300 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 0.9830 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.9380 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -2.7570 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -1.6070 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -1.6010 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -0.4550 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -0.0240 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -1.9620 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -1.3210 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -5.5730 3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -7.0940 3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 -7.4270 3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -8.3800 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -9.8890 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -11.3490 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5310 -11.0820 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6910 -9.3570 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4110 -7.8780 2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.3100 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -1.8630 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -4.2360 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -4.0790 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -5.3290 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 -3.6570 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -4.8240 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -5.9770 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -4.7240 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -2.0990 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6990 -2.7690 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -6.7100 2.3720 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9050 -6.2230 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -7.0880 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 53 1 0 0 0 0 6 7 3 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 55 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 55 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 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 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 M CHG 1 53 1 M CHG 1 55 1 M END