IFLAB-ZINC04339978 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0150 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 3.4740 2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 3.6820 3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 4.0950 4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 4.2990 4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 4.0940 3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 3.6820 2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 3.4900 0.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 3.6840 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 3.4940 -0.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 4.1000 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 4.3060 2.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 4.7420 3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2920 3.9710 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1510 4.4750 5.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1560 3.6650 5.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9570 4.1590 6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7840 5.4570 7.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8190 6.2750 6.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0040 5.8010 5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0890 6.6170 5.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9990 6.0140 4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 6.5060 4.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1920 3.1540 7.5760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 3.4830 3.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.3320 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.0740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.3810 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 3.4080 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 3.4130 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 4.2540 5.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 4.6180 5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7600 4.2480 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 3.0160 3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3010 2.6590 5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4110 5.8300 8.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6960 7.2850 7.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 4.2690 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 44 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 44 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 3 44 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 27 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 27 43 1 0 0 0 0 M END