COMGENEX-ZINC04589976 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5600 -1.7290 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -0.7310 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 -1.5470 -1.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5530 -2.9010 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 -3.2410 -1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5670 -2.1360 -1.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 -1.1100 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 0.5510 -0.9680 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 0.3420 -0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6710 1.6720 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8610 2.0740 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 3.2950 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8530 4.1230 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 3.7340 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 2.5000 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8920 2.0870 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7420 1.7600 -4.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 -3.8240 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 -5.1530 -2.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -0.0430 0.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 -1.1580 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.2850 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 -4.2340 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2590 -0.3590 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4150 -0.0470 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5490 1.4330 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5960 3.6050 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3120 5.0750 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9840 4.3810 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -3.8120 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -3.4910 -2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 -5.8020 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 0.8730 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 3 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 M END