IFLAB-ZINC05252430 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.0180 1.4990 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.0080 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -0.6070 0.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -0.6890 -0.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 0.0220 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -0.5940 -2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -2.0570 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -2.7780 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -2.0890 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.7810 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.1660 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -4.8550 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -4.1600 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -4.8660 0.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -6.0680 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -6.5800 -0.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -6.7690 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -6.2570 2.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -7.9700 0.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -8.6580 1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 -9.9710 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 -10.0420 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 -11.2720 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 -12.3780 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -12.2730 0.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -11.1210 1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 1.8480 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.8530 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 1.8860 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 1.0790 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -0.0950 -2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -0.5380 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -0.0510 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -2.5410 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -2.1030 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -2.2420 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -5.9330 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -4.6990 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -4.4880 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -8.3800 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -8.0360 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -8.8420 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -9.1610 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -11.3640 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 -13.3390 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -11.0750 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 M END