IBS-ZINC05317725 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 52 0 0 1 0 0 0 0 0999 V2000 1.8950 -2.5980 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.3640 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -0.8750 0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4280 -0.3850 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -0.7550 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -0.1470 -0.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9600 -0.3830 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 1.3810 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 2.0540 -1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 1.8930 0.9640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 3.2930 1.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0910 3.9450 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 3.5810 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 3.5870 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 4.0160 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 4.0380 0.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 4.3600 -1.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 4.6620 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 4.3220 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 3.5960 2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 2.5520 3.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -0.4820 -1.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -1.5350 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -2.3300 -1.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -1.5570 -3.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -2.5830 -3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -3.9760 -3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 -2.2540 -5.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -2.5080 -3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -2.3210 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -2.0270 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -3.6590 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -2.9240 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7990 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -1.1730 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 0.2880 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -1.2990 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 1.3180 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 2.8400 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 4.5560 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 4.2630 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 2.5850 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 0.1200 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -3.9850 -4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -4.7310 -4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -4.2930 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 -1.2470 -5.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -2.9670 -5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -2.2610 -5.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -2.7990 -2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 -3.1680 -3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 -1.4840 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 4.8150 3.0910 O 0 5 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M CHG 1 53 -1 M END