COMGENEX-ZINC04458975 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -2.5480 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -4.0540 2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -4.6630 1.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -4.7260 3.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -6.1910 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -6.6970 4.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -8.6860 5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -10.2130 5.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -10.7590 5.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -10.2390 4.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -8.7120 4.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -12.1420 5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -12.9580 5.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -14.2450 5.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -14.6110 5.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -13.1720 5.6130 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -15.2640 5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -15.5990 4.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -16.6340 3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -16.9410 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -16.2130 2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -15.1780 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -14.8740 4.1010 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 -1.0200 -0.3810 0.0100 H 0 0 0 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -2.1700 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -2.1960 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -4.2390 4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -6.5680 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -6.5420 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -6.3200 4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -6.3460 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -8.3950 6.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 -8.2780 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 -10.5040 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -10.6030 6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -10.5300 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -10.6480 4.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -8.3220 4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -8.4210 5.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -16.1670 6.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -14.8570 6.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -17.2020 4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -17.7490 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -16.4520 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -14.6100 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -14.0690 4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -8.1660 4.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 59 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 11 59 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 15 59 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 M END