IBS-ZINC04023923 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 59 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7890 -2.4840 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -2.5900 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -3.2160 -0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -2.3710 1.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -2.8880 1.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9580 -3.8470 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 -3.0740 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -4.1570 3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -4.3430 4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -5.3800 5.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -5.7220 6.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -6.6940 7.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8510 -1.9120 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 -0.8880 0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.4260 -1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -2.5240 -1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -2.3070 -0.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -2.8630 -2.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -2.9500 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -4.0050 -1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -3.3440 -4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -1.5920 -2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -1.8700 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0570 -2.1350 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 -3.3740 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -5.0960 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 -3.8570 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 -3.4040 5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -4.6430 4.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -5.8250 4.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -7.1400 6.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -6.9360 8.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -2.6000 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -4.9730 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -4.0700 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -3.7250 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -2.5920 -5.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -3.4090 -4.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -4.3110 -4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -1.3120 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -1.6570 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -0.8400 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -5.1230 7.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3630 -4.4370 7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1660 -2.1790 0.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7480 -1.5220 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 57 2 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 59 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 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 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 57 58 1 0 0 0 0 59 60 1 0 0 0 0 M END