IBS-ZINC02430748 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 0 0 0 0 0 0999 V2000 -0.1120 1.5000 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 0.0080 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -0.5150 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.8840 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.7300 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.2070 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.8380 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.2680 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -4.4750 -0.0540 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -5.0250 -1.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.6870 1.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -5.0090 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -4.9040 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -5.3620 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 -5.2680 -2.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -4.7350 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -4.6230 -4.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 -4.0780 -5.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 -3.6280 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -3.7210 -4.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -4.2770 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -4.3740 -2.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -5.9130 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 -6.2590 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -7.3510 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 -7.6940 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2020 -6.9500 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8030 -5.8540 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 -5.5070 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9090 -5.2950 -1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0290 -5.8100 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5580 -7.0770 0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 1.8910 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 1.7250 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 1.9650 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 0.1460 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.2920 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.8680 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -0.1010 -3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -0.9690 -3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 0.6780 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -5.3950 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -4.9680 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -3.9940 -6.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -3.2000 -6.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -3.3690 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -6.0580 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 -7.9340 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5660 -8.5440 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 -4.6550 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2780 -5.1440 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8910 -5.9490 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 47 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 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END