COMGENEX-ZINC06777281 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 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 0.1590 -1.2130 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.6470 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -0.1170 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -0.3170 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 -0.0330 5.0180 C 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 -1.8750 -1.3580 -1.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5840 -0.9520 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -1.2780 -0.8620 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -0.7930 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -0.2240 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 0.4600 1.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -2.7740 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -3.5600 -2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -4.8570 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -5.3710 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -4.5840 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -3.2830 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -5.2260 2.0560 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -7.0010 -0.4710 Cl 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 2.4760 0.4060 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.2950 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -1.7360 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -0.4680 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 0.9730 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 0.7600 3.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -0.8100 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8130 -0.6880 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -0.3190 5.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 1.0540 4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -0.4100 5.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 -0.0360 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -1.6640 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -3.1590 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -5.4710 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -2.6670 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -0.6040 3.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 45 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 45 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 44 1 0 0 0 0 M END