IBS-ZINC02401594 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 0.5200 2.0420 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 0.5340 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 0.0100 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -1.4980 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -2.0220 2.5540 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0100 -1.4600 3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -3.4810 2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -4.3030 2.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -1.8610 2.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -1.8240 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -1.7640 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 -1.8100 4.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 -1.5990 3.4630 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4860 -2.4070 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 -0.2560 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -1.6370 4.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 -2.0140 4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 -2.1790 6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 -2.5570 6.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6010 -2.7800 5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0130 -2.6150 3.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 -2.2360 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7490 -2.8310 2.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0330 -3.2030 2.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6570 -3.3840 1.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6900 -3.3920 4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0100 -3.1850 5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6270 -3.3410 6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9140 -4.1610 6.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7960 -3.5620 5.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1310 -3.8280 3.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 2.2420 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 2.4160 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 2.5430 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 0.3340 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 0.0340 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 0.2100 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 0.5110 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -1.6980 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -1.9980 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 0.5520 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4730 -0.1360 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 -0.2270 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 -2.0060 7.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2970 -2.6830 7.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -2.1110 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8550 -2.3560 6.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9210 -3.8470 7.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4380 -4.1190 7.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6750 -5.1970 6.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8960 -2.4870 5.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7810 -4.0290 5.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1810 -4.8950 3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6610 -3.2780 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -3.8680 2.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -4.8150 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 55 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 55 56 1 0 0 0 0 M END