IBS-ZINC02250688 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 2.1920 0.9610 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -0.3700 -0.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -0.8620 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -0.1980 1.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.2060 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -2.9320 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.1890 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -4.7380 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -4.0330 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -2.7680 2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -2.0570 3.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -2.7100 4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -3.9040 3.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -1.9580 5.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -2.9120 5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -4.0870 5.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 -2.4590 7.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 -3.3560 7.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2220 -4.6760 7.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8730 -5.5630 8.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 -5.1470 9.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 -3.8410 9.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 -2.9320 8.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 -1.5350 8.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 -0.7250 7.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3160 -1.1560 9.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7140 0.2350 9.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 0.9710 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 1.2360 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 1.6760 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.5090 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -4.7490 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -5.7240 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -4.4680 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -1.0920 3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 -1.1820 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -1.5000 5.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -1.5080 7.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -5.0080 7.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 -6.5890 8.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 -5.8490 10.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 -3.5210 10.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9040 0.4680 8.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 0.8750 9.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6210 0.4050 9.7160 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 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 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 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 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END