IBS-ZINC04898159 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.4610 1.3430 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.1390 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -0.9010 1.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -2.2930 0.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -3.0790 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -2.5800 3.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -4.5760 1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -6.6580 3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -7.2600 4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -5.4600 5.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -4.8570 3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -7.5410 6.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -7.5010 7.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -6.6020 8.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -6.5650 8.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3850 -7.4280 8.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -8.3280 7.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -8.3610 6.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -9.4850 5.5480 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -0.7220 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -0.3920 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -1.0810 -3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -1.9620 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -1.9620 -1.5300 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 1.5520 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 1.8720 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 1.6780 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -2.6920 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -4.8390 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -4.9330 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -6.8860 2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -7.0800 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -8.3440 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -6.8590 4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -5.0370 5.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -5.2310 5.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -5.2590 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -3.7740 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -6.9970 7.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -8.5770 6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -5.9280 8.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -5.8630 9.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -7.4000 8.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 -9.0020 7.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 0.3480 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -0.9210 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -2.5840 -3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -5.2000 3.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -6.9170 5.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 48 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 49 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 49 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 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 M END