IBS-ZINC02329554 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.2550 0.9720 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.3940 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -0.8670 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0240 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 1.4000 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 1.8680 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 -0.5260 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -0.5120 1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -1.7030 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 -1.7240 3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 -0.5570 4.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4740 0.6330 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 0.6600 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 -0.5170 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0130 0.1820 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 0.1610 -3.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 0.6960 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 0.0160 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1260 -0.3340 -4.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 -0.8260 -4.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4540 -0.2770 -5.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3800 -0.7400 -6.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0270 -1.5580 -6.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2930 0.4140 -7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6530 1.3210 -6.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7430 0.3670 -8.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2810 -0.5780 -9.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 -1.7180 -8.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 1.3390 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -1.0930 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -1.9410 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 2.1310 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 2.9340 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 -1.5760 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -2.6310 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 -2.6520 4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 -0.5750 5.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 1.5450 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 1.6100 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -1.5830 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 -0.3900 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1550 1.2350 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0030 -0.2850 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 1.7700 -3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 0.5840 -4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.5210 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -1.0470 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5830 -0.9430 -5.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 0.7430 -5.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4160 1.0790 -8.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 0.0020 -10.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1570 -0.9670 -10.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -2.1760 -9.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 -2.5090 -8.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.1020 -0.8020 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8330 1.0950 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 -1.2370 -7.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 -0.4660 -8.2490 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 55 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 55 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 57 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 57 1 0 0 0 0 55 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 55 1 M END