IBS-ZINC02129626 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 0.1310 0.9050 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 0.8170 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 1.1930 3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 2.6870 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 3.1920 4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 4.5570 5.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 5.4290 4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 4.9720 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 3.5680 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 3.0030 1.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3540 3.2590 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 3.5670 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 4.3650 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 4.9030 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 5.6620 -3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 6.1730 -4.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 5.9250 -3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 5.1520 -2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 4.6460 -1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 3.8150 -0.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 3.1280 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 2.1610 0.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 4.7320 -0.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 5.7490 1.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 7.1630 1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 6.7230 4.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 6.5610 5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 5.1840 6.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.1810 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.1780 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 1.3200 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 1.1590 2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 -0.2680 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 0.7980 3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 0.7340 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 2.5360 5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 5.8620 -3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 6.7640 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 6.3250 -4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 4.9350 -2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 5.6480 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 7.5980 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 7.5140 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 7.5040 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 7.0390 6.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 7.0640 5.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 1.4550 1.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7170 1.2180 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 47 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END