IBS-ZINC02154532 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.3550 2.5780 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 1.0650 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 0.5070 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -1.0140 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -1.5630 0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 -3.7230 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 -5.2320 0.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8070 -5.5530 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -6.1350 0.6870 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2250 -7.1140 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -6.2170 -0.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8890 -5.2800 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 -7.3470 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 -7.0680 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8830 -6.9140 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2530 -6.4740 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2470 -5.7240 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4690 -6.5030 1.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.0170 -7.4500 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9870 -6.8640 0.7790 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9140 -5.7890 1.2260 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8570 -5.7490 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2460 -4.4740 0.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7710 -4.5470 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6700 -8.2190 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5870 -5.7990 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1690 -6.3570 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 -5.5920 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -5.1700 -0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 2.9550 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 2.8770 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 3.0590 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 0.6170 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 0.7990 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 0.9610 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 0.7800 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -1.4690 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -1.2870 2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -1.1710 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -1.3510 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 -3.3520 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -3.3970 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4380 -7.3970 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 -8.3200 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7390 -7.0780 -2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6650 -5.8150 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9070 -7.3510 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8290 -4.7210 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2850 -5.5770 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6880 -8.6240 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7030 -8.1170 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3990 -8.9890 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6380 -5.7270 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0630 -6.3520 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1900 -4.7800 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -3.0490 1.1370 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5010 -3.4550 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 -3.2820 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 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 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 56 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 6 56 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 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 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 M CHG 1 56 1 M END