IFLAB-ZINC04250491 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.4470 1.4370 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 0.0090 1.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -0.6290 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 0.1040 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -0.5390 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.9150 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -2.6690 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -2.0190 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.7420 1.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -3.0580 3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 -4.1420 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -4.7960 1.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -4.7640 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -6.1550 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -6.8680 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -8.2450 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -8.9240 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 -8.2320 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -6.8400 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2770 -6.0930 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5230 -6.6610 -0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 -7.6100 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4420 -5.6290 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8290 -5.5740 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4640 -4.3500 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7270 -3.1740 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3620 -3.2080 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6950 -4.4380 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 -4.7860 -0.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 1.8180 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 1.7670 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 1.8160 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 1.1830 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 0.0410 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -2.4100 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -2.1360 3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -3.6430 3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -3.6370 3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -4.2440 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -6.3450 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -8.7960 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 -10.0020 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 -8.7660 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4070 -6.4860 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5430 -4.3070 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2390 -2.2230 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7980 -2.2870 -0.1590 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 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 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 29 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 M END