IFLAB-ZINC04120650 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -1.4710 -5.3470 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -4.4820 1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -5.0720 0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -6.4570 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -7.0630 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -6.2960 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -4.9030 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -4.2930 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -4.0780 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -2.8710 -2.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -4.6650 -3.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -6.1150 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -6.2030 -4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -4.8010 -5.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -4.0130 -4.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -2.2570 -4.4240 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -2.0870 -5.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -0.6250 -6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 0.0540 -5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 1.3950 -5.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 2.0560 -6.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 1.3780 -7.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 0.0350 -7.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 2.0860 -8.1960 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4680 3.2680 -8.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 1.4880 -8.6650 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2610 -5.9560 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -5.9960 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -4.7490 3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -7.0620 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -8.1400 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -6.7720 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -3.2160 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -6.5760 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -6.5810 -3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -6.7110 -4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -6.7160 -5.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -2.5580 -5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -2.5700 -6.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 -0.4630 -5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 1.9250 -5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 3.1040 -7.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -0.4960 -7.4620 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 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END