IBS-ZINC02396428 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -5.0760 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -5.3270 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -5.7570 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -6.0630 -1.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -5.9810 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -6.3060 -3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -6.2210 -5.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -5.8130 -5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -5.4900 -4.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -5.5660 -3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -5.2500 -2.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -5.7370 0.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -5.3330 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -5.2050 2.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 -6.0770 1.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7690 -7.3030 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 -7.6610 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -8.9780 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0210 -9.2680 4.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8440 -8.3250 4.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7340 -7.0720 4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -6.6920 3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 -6.6240 -3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0490 -6.4720 -5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -5.7530 -6.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -5.1760 -5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -4.9130 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -5.4080 3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -8.0610 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -9.7550 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1480 -10.2810 4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4310 -6.3330 4.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 -5.6630 3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 2 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 M END