IBS-ZINC04889282 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -0.5050 2.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -1.0220 3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -1.2530 4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -1.8020 5.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -2.1340 4.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -1.9150 3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -1.3580 2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -1.0230 1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -1.1930 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 0.0470 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 0.1500 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 1.2870 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 2.3220 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 2.2200 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 1.0790 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 3.5200 -2.0870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -0.3400 -2.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -1.1330 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 -1.2650 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -1.7550 -2.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1970 -1.9400 -3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4180 -2.4380 -2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3120 -2.5370 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 -2.1310 -1.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -0.9980 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -1.9790 6.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -2.5670 4.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -2.1740 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -2.0510 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -1.3580 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 -0.6580 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 1.3670 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 3.2110 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 0.9970 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -1.4010 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -0.9970 -3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 -1.7390 -4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2820 -2.6960 -3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 -2.8900 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 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 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 M END