COMGENEX-ZINC06801648 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -1.3420 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -1.9880 2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -2.6920 3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -2.5840 4.4650 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -1.5550 3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -0.8780 2.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -0.2480 1.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -0.8290 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -0.7860 2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -0.7380 3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 -0.7330 4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 -0.7750 5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -0.8170 4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -3.4460 4.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -3.4620 3.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -4.1220 5.4210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -4.8760 5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -5.5450 7.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 -6.2980 7.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -6.9740 8.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -6.9590 9.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -7.7490 9.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 -8.4180 10.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -6.7960 9.8050 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 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -1.9230 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 -0.7910 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 -0.7050 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9480 -0.6950 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -0.7710 6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -0.8450 5.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -4.1100 5.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 -4.1970 6.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 -5.6380 5.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -6.2240 7.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -4.7820 7.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -6.3110 7.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -8.5120 8.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -7.6560 11.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2870 -8.9790 11.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -9.0970 10.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3270 -6.3190 8.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8720 -7.3570 10.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 -6.0340 10.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 11 2 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END