IBS-ZINC04090650 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.7290 1.8400 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 0.4130 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 0.3820 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.0280 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -0.5300 0.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0510 -0.4610 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -0.1400 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -0.5870 -2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 0.7070 -0.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 1.2390 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 1.6100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 2.1510 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 1.2590 -2.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5220 0.4490 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 2.0810 -2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 2.2000 -2.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -1.9060 -0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -2.6460 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -2.1710 2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -3.9120 0.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -4.5090 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -5.9270 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -6.4220 -1.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -6.6500 0.7610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -6.0860 1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -4.7000 2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -4.1270 3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -4.9310 4.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -6.3030 4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -6.8860 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 2.4950 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 2.1870 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 1.8520 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 0.0030 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -1.0440 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 0.6440 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 0.4770 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 2.1240 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 0.7300 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 2.3840 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1020 2.0300 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 3.1950 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.2850 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -3.9330 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -4.5080 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -7.5720 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -3.0550 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -4.4860 5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -6.9260 5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -7.9580 2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 2.6820 -4.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 3.1990 -4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 51 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 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 30 50 1 0 0 0 0 51 52 1 0 0 0 0 M END