IBS-ZINC02131644 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.0160 0.3990 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -0.7210 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -0.8450 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 0.1460 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 1.2610 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 1.3950 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 2.2960 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 3.2810 1.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 2.0580 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 0.9150 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 -0.0180 -0.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 3.0280 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 2.6730 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6680 3.5120 1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 4.5040 0.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 3.0170 2.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3460 2.1570 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8450 3.5990 2.8290 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2520 4.0960 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7640 4.5540 4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 5.8290 3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6860 5.9850 4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9740 7.1570 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 8.1760 3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 8.0380 2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 6.8660 3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9180 9.3380 2.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 9.2780 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8170 2.4870 3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2360 1.4270 3.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 0.4950 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -1.4980 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -1.7180 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 2.2670 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 0.8320 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 3.0270 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 4.0340 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 2.8270 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7040 1.6150 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3080 4.0420 4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7700 4.8400 4.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2060 5.1850 4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 7.2490 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3410 8.8380 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6080 6.7620 2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0450 2.7710 3.2550 O 0 5 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 29 30 2 0 0 0 0 29 46 1 0 0 0 0 M CHG 1 46 -1 M END