CHEMBRIDGE-ZINC04545807 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.5460 0.8220 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.5090 -0.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8380 -0.3610 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -1.0170 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -1.8760 1.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -0.5170 1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 -0.9020 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -1.3440 3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -1.7240 4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 -1.6680 4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 -1.2320 3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -0.8500 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -0.3880 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 0.0340 0.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -0.4340 1.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0700 0.0250 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4340 -0.6660 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2780 -0.1880 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4710 1.3270 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1060 2.0180 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 1.5400 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.7190 -0.7800 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -1.0150 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -1.9200 -2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 -1.7370 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -2.5680 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 -3.5810 -3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -3.7630 -4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -2.9300 -3.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 1.5490 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 1.1900 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 0.6740 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 0.1110 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -1.3900 3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -2.0660 5.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 -1.9680 5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7970 -1.1900 3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 -0.7700 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 -0.2210 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9440 -0.4210 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2970 -1.7460 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2500 -0.6800 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7680 -0.4340 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9800 1.5730 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0720 1.6680 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2440 3.0980 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5970 1.7720 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 2.0320 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7720 1.7860 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -0.0310 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.9210 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -0.9460 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -2.4250 -2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5930 -4.2300 -4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -4.5550 -4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -3.0700 -4.0450 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 22 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 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 38 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 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 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 M END