COMGENEX-ZINC06695734 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -1.4040 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 -1.8630 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -1.4420 0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -0.6000 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.1520 0.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -0.0670 2.2610 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 1.0260 3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 1.6140 4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 0.9590 5.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 1.4920 6.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5600 2.6830 6.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5740 3.3500 5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 2.8080 4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 4.6260 5.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 5.2040 4.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9640 5.1480 6.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6900 6.4120 6.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3310 6.7730 7.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7680 7.5090 8.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7150 7.5990 9.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8000 6.9120 9.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5650 6.4180 7.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -2.7440 -1.8770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -3.2860 -2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -4.5840 -2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0420 -3.1340 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -2.1600 -2.7530 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -1.7270 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 0.4550 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 1.8290 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 0.0260 5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 0.9750 7.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 3.0980 7.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8940 3.3220 3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9550 4.6860 7.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 7.1990 5.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4610 6.3050 5.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7810 7.9480 8.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5900 8.1190 10.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7090 6.7820 9.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -3.4880 -3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -2.5610 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -4.3820 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -5.3090 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -4.9870 -3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -4.1420 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 -3.1090 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 -1.1510 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -2.1840 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8870 -2.4500 -2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 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 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 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 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M END