IBS-ZINC04089257 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.1080 1.0870 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.2730 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -0.7010 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 0.2300 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 1.5960 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 2.0210 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 -0.2420 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 -0.7570 -1.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 -1.3050 -1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 -1.8300 -2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 -2.3610 -3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 -2.4170 -2.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5410 -1.9010 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 -1.3590 -0.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5400 -2.7970 -4.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 -2.5070 -4.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -1.9160 -3.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5680 -3.4240 -5.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5300 -3.1340 -4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -4.9670 -5.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5990 -5.2400 -5.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -5.0850 -6.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0950 -6.0000 -7.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2310 -3.8130 -7.6610 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4180 -3.4210 -8.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 -2.8020 -6.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 -3.9800 -8.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8220 -2.7300 -9.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6880 -2.0640 -8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 -5.1140 -6.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -5.4750 -5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 -5.6330 -4.6640 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1330 1.4200 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -1.0020 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -1.7660 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 2.3370 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 3.0810 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 0.5880 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -1.0130 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -0.7330 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 -1.9200 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -2.7440 -5.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3570 -4.2680 -7.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 -4.7240 -9.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 32 -1 M END