COMGENEX-ZINC04711668 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 -1.0200 -0.3810 0.0100 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 1.7250 -1.1860 1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -0.1910 2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -0.6510 3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -1.3870 3.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -1.7220 4.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -1.2910 5.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.3360 5.2030 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -1.5520 7.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -2.3240 7.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -2.5640 8.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -2.0410 9.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -1.2740 9.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -1.0220 8.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.6080 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -0.3350 -2.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -1.0430 -3.4670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -1.1860 -4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 0.1710 -5.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -1.6920 -5.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -2.1870 -4.5310 C 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 -0.5170 0.3560 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -2.7340 6.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 -3.1620 8.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -2.2320 10.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -0.8690 10.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -0.4200 7.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -0.6950 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -1.2610 -3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 0.8840 -5.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 0.0650 -6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 0.5310 -4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.6580 -5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -1.7980 -6.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -0.9780 -5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -1.8260 -3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -2.2930 -5.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -3.1540 -4.2390 H 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 18 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 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END