IBS-ZINC05219349 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.4050 1.5060 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 0.0390 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -0.6840 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -2.0140 0.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -3.1890 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -4.3800 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -4.4150 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -3.2840 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -2.0180 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -0.7980 -1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -0.3210 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -0.4910 3.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 0.1510 2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 0.5440 4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 1.0800 4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 1.4990 5.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 0.9980 3.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 0.3850 2.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4060 1.1470 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -0.8770 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -0.9570 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -2.1170 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 -3.1990 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -3.1460 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -1.9890 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 -4.3100 -0.0480 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 1.5120 2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 0.6620 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5680 2.4950 3.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2830 0.1390 3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 0.4430 5.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 1.9180 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.7570 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 1.9910 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -3.0990 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -5.3160 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -5.3880 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -3.3120 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 -0.1250 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -2.1830 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 -4.0080 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -1.9710 3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 1.5920 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 2.5250 3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 0.6460 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 -0.3680 3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4940 2.3970 4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 3.2460 3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5850 2.7610 3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 -0.7770 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2830 -0.0320 4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 0.5250 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -0.1960 4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2260 1.1680 3.2000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.2520 1.2920 2.1780 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 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 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END