IBS-ZINC04844305 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 1 0 0 0 0 0999 V2000 0.2710 -0.9200 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -2.1400 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -2.3620 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -1.3630 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -0.1430 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 0.0800 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -1.6040 0.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6980 -2.5510 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -1.7410 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 -0.9130 -1.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2850 -0.0060 -1.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 0.2250 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 -0.5190 0.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 -0.1990 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 -0.8020 2.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 0.9180 2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 1.4380 3.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 1.0010 4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 0.7380 6.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 0.3290 7.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 0.1780 6.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 0.4380 5.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 0.8520 4.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -0.2260 7.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 1.4360 1.3310 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 -2.7750 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 -2.6230 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -3.5970 -4.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -4.7220 -3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -4.8800 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -3.9180 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -0.7480 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.9200 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -3.3150 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 0.6380 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 1.0330 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 2.1720 4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 0.8550 6.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 0.1250 8.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 0.3180 5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 1.0590 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 0.4990 8.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -1.7450 -3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -3.4810 -5.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -5.4810 -4.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -5.7610 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -4.0440 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 M END