IBS-ZINC04837617 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -1.8090 0.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -2.5760 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -2.3090 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -3.0910 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 -4.1480 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -4.4280 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -3.6410 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -3.9090 2.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -4.8890 3.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -5.1580 4.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -6.2200 5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -6.4900 6.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -5.7040 5.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -4.6430 5.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -4.3680 4.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -5.9950 6.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -6.9170 7.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 -2.7490 -0.6140 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -1.1440 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -0.0520 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -1.4880 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 -4.7540 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -5.2520 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -6.8270 5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -7.3100 6.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -4.0360 4.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -3.5460 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -5.2380 6.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 -5.4660 7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 34 35 1 0 0 0 0 M END