COMGENEX-ZINC04527848 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 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 0.0900 -4.6850 2.8460 C 0 0 3 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 -1.0960 -4.2910 1.9640 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 -1.3170 -4.7100 4.9100 C 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 3.3120 -3.8490 3.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -5.9680 3.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -6.4200 3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -5.6750 4.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 -6.2550 5.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6890 -7.5580 5.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -8.1070 4.1810 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6840 -8.4220 5.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 -7.8510 6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6560 -8.6610 7.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5490 -10.0420 7.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 -10.6140 6.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 -9.8110 5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 -10.8360 7.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2950 -12.2480 7.5290 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 -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 0.7940 -4.2900 4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -3.0070 4.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -4.2820 5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -4.5050 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -5.7870 4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -6.6040 2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 -6.7770 6.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4650 -8.2200 7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 -11.6880 6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 -10.2570 5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3290 -12.5410 7.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3360 -12.5170 6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0900 -12.7640 8.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 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 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 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 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END