IBS-ZINC04116732 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 0.2130 1.5010 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -0.0050 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -0.7200 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -2.1010 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -2.7710 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -2.0500 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -0.6690 -0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 0.1150 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1680 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -4.8690 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -4.1520 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -4.7770 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -6.2300 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -6.9620 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -6.2280 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -6.9290 -0.1740 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3340 -7.1270 -0.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -7.3080 -0.6530 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5680 -8.2110 2.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -8.2540 3.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -7.1880 4.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -4.0450 4.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -3.2940 4.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -2.6190 6.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -1.6760 6.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -2.4740 6.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -3.1530 4.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 1.8470 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 1.8920 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 1.8540 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -0.1990 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -2.6590 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -2.5680 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 0.2870 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -0.4480 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 1.0720 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -4.6490 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -3.0760 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -2.5350 4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -3.9770 4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -2.0490 6.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -3.3790 7.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.8940 5.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -1.2260 7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -1.8000 6.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -3.2310 6.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -3.7340 4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -2.3950 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END