IBS-ZINC04811779 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.1590 1.5070 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 0.0030 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -0.7230 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -0.4440 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -1.6140 3.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -2.6720 2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -2.2010 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -2.7440 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -1.9280 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -0.6550 -1.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -4.2340 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -4.1210 2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -1.7160 4.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -1.6970 5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -1.8040 6.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -1.7840 7.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -1.8860 8.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -2.0080 9.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -2.0270 8.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -1.9330 7.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -1.9590 6.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -1.8670 9.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -1.9610 10.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 -1.9420 11.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9650 -2.0440 12.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -2.0230 13.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3560 -1.9030 12.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3720 -1.8020 11.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 -1.8140 10.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 0.9310 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.8100 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.9060 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 1.8930 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -4.5480 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -4.4880 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.7430 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -4.4390 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -4.7290 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -4.2430 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -1.6030 4.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -1.6900 6.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.0870 10.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -2.1210 9.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -1.0870 6.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -2.1380 13.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 -2.1020 14.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2850 -1.8880 13.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3120 -1.7090 11.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2020 -1.7300 9.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 1.3230 3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 0.8710 4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 1.5920 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END