COMGENEX-ZINC04454975 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 70 0 0 0 0 0 0 0 0999 V2000 1.7750 1.6400 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 0.1440 1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.1640 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -1.6600 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -1.9550 0.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -1.8950 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -3.2470 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -4.2000 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -5.2980 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -4.9740 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -3.7140 -1.8070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -2.9840 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -2.2820 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -2.5270 1.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -2.3440 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -2.7180 3.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -4.1310 4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -4.5910 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 -3.8750 6.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -6.1020 5.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -1.7630 4.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -0.5990 4.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -2.0990 5.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7030 -1.1300 5.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8060 0.0730 5.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7140 1.0270 5.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5220 0.7850 6.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4220 -0.4120 7.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5190 -1.3720 6.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 -2.6780 7.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -2.5860 8.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 1.8590 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 2.2080 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 1.9170 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -0.1330 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -0.4250 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 0.1130 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 0.4040 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -1.9370 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -2.2290 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -1.6120 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -1.1560 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -4.1340 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -6.2290 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -5.6030 -2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -3.1940 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -3.3000 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -1.9140 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -3.0870 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -1.3680 3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 -4.2570 4.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 -4.7280 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -4.3520 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -4.2570 7.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -2.8040 6.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -4.0540 6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -6.6120 4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -6.4300 6.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -6.3410 5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 -3.0120 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 0.2620 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 1.9620 4.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2320 1.5330 6.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0540 -0.5970 8.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 -2.8870 8.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1910 -3.4800 6.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -2.2850 8.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5620 -1.8480 9.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -3.5580 9.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 53 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 27 28 2 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 M END