COMGENEX-ZINC06777029 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1370 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4900 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8700 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.6300 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0080 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -2.7540 0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -4.1740 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -2.5480 4.3150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1440 -3.5220 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -1.7020 5.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -1.5710 6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.8970 7.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 -2.3110 5.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -2.7140 3.9840 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -1.0250 5.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -1.9220 6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -3.0200 7.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -1.5060 7.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -2.3780 8.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -1.6810 8.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 -1.7460 7.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 -0.9480 8.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 -0.4420 9.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -0.8950 9.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 1.2150 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1000 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -3.7080 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.6480 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -4.4700 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -4.4890 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 -1.6670 5.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 -3.2210 6.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -0.0990 6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.7980 5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -0.6280 7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -3.3040 7.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -2.6040 9.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -2.3010 7.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -0.7760 8.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 0.2130 10.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 18 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 37 1 0 0 0 0 16 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 M END