IBS-ZINC01322111 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 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 0.0240 -0.8300 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1150 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1020 -0.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7660 -1.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.2790 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -3.7010 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -3.3500 -2.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -3.7370 -3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 -4.4780 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -4.8320 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -4.4490 -0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -4.8010 0.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -5.5700 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -3.3510 -4.5630 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4050 -2.5070 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9000 -4.5230 -5.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -4.8880 -6.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -6.0410 -7.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 -6.8360 -7.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -7.8740 -8.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 -8.1330 -8.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -7.3630 -7.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 -6.3020 -6.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -5.3650 -5.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -5.3040 -5.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 -4.1670 -6.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 -2.8020 -5.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -3.3400 1.5820 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 0.0300 -0.5010 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -3.0330 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.0940 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -2.7710 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -4.7790 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 -5.4100 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -5.0080 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -6.5070 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -5.7830 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2390 -6.6430 -8.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -8.5100 -9.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -8.9630 -8.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -7.5750 -6.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -4.0240 -7.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 -4.7460 -5.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -2.1580 -6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0380 -2.3420 -5.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.6500 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -4.1460 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -3.1110 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3410 -2.9820 -4.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -3.6630 -3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 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 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 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 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 54 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 54 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 54 55 1 0 0 0 0 M END