COMGENEX-ZINC06689992 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 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 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -2.6260 0.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -2.6890 2.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -4.1540 2.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4690 -4.5100 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -4.6450 3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -4.1840 4.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -4.8480 4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -4.7620 5.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 -5.6080 5.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 -6.5390 4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 -6.6250 3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -5.7880 3.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -5.6380 2.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -6.4050 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -5.7000 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -6.2830 -1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3680 -6.4410 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -5.5240 7.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 -4.7180 8.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -4.6850 2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -4.0850 4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -4.2910 1.9640 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 1.7850 -2.2020 2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 -4.0450 6.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0580 -7.1920 5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 -7.3450 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 -7.4060 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 -6.4770 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 -4.6160 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -7.1700 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -5.5840 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 -5.8460 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5830 -7.4320 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -5.7710 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -2.9990 4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -4.4630 4.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -4.3650 4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -3.2050 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -4.7190 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -4.6700 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -6.3420 7.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2950 -6.2500 8.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 52 53 1 0 0 0 0 M END