IBS-ZINC05343159 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 0 0 0 0 0 0999 V2000 -0.4320 1.9670 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 0.4550 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -0.1710 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -0.4080 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -0.9820 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -1.3200 2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.0850 2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.5030 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -0.2580 2.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 0.9270 2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 1.7520 3.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 1.2430 3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 2.4720 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 2.7320 4.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 1.7840 3.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3750 0.5630 3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 0.2830 2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -1.0090 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 -1.9880 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -3.2140 1.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 -4.2230 1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 -5.5030 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -6.5580 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 -8.7360 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -9.9740 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -10.5450 0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -9.6480 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -8.4070 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -1.2150 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -2.2670 1.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 2.3870 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 2.4200 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 2.1730 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 0.0350 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.2490 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -0.1460 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -1.1670 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -1.7680 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -1.3500 3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 3.2160 3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 3.6830 4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7300 2.0050 4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 -0.1710 3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 -1.7820 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -3.4210 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8070 -4.4390 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7700 -3.8470 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -5.2880 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -5.8800 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1280 -6.7730 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 -6.1810 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -8.2650 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 -9.0310 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 -10.7050 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -9.6880 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -10.1430 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -9.3520 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -8.6960 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -7.6950 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -7.7870 0.0190 N 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 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 60 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 60 1 0 0 0 0 25 26 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 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 M END