COMGENEX-ZINC06765990 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -0.3410 -2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -1.1090 -1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -1.4730 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -0.2520 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 0.1250 -0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 1.2620 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -1.2520 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -2.6280 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -2.8100 -3.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 -4.0720 -4.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -5.1560 -4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -4.9800 -2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -3.7150 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -3.5400 -1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8330 -3.2460 -1.9390 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 -2.8960 -0.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7020 -2.3940 -3.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5080 -4.7610 -2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1960 -5.5950 -1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7260 -6.7840 -2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5680 -7.1390 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8790 -6.3020 -4.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 -5.1120 -3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0860 -8.3010 -3.9210 F 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 0.5120 -0.3560 -0.8950 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 0.7570 -1.6010 1.2360 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 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -2.2720 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -1.8160 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 -0.4980 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 0.5750 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9170 1.0470 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8140 2.1200 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 1.4840 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -1.1130 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -0.5020 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -1.9650 -4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -4.2120 -5.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 -6.1410 -4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 -5.8270 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3190 -5.3180 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2630 -7.4350 -1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7550 -6.5780 -5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8200 -4.4570 -4.5340 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 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 38 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 11 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 M END