IBS-ZINC02392941 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.9020 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.2930 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -3.8180 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -4.1920 3.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -4.3820 4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -4.7160 6.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -4.8920 6.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -4.7100 4.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -4.3530 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -4.1910 2.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7370 -4.9650 5.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 -5.2900 6.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -5.2360 7.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0060 -5.5070 8.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -6.9960 8.7060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9600 -7.3060 7.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -7.2910 10.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 -8.6690 10.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -9.0440 9.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 -7.7820 8.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 -5.5720 7.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0180 -5.5520 6.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2370 -5.8490 7.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 -5.8220 6.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 -5.5030 5.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2360 -5.2090 4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0180 -5.2270 5.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 -4.9420 4.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -2.3180 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.2920 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -1.8760 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -1.9020 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.2340 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -4.2090 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -4.2520 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 -5.2350 9.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -4.9210 8.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -6.5330 10.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -7.3420 10.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 -8.5920 11.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -9.4020 10.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -9.5560 9.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -9.6700 8.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2540 -6.0980 8.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3290 -6.0510 7.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3290 -5.4880 4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 -4.9630 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 M END