IBS-ZINC06662000 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0040 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.6860 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -4.0850 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -4.7330 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -3.9720 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -2.6540 -0.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -4.8580 -3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -4.3450 -4.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -5.1740 -5.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -6.5000 -5.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -6.6160 -3.6040 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -7.6270 -6.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -7.4050 -7.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -8.4820 -8.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -8.2520 -9.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -9.1870 -9.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 -6.9880 -9.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -9.0410 -5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -4.7030 -6.7700 C 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 0.5290 -0.3650 0.8850 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 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -2.1470 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -5.8110 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -4.4620 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -9.3920 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -6.2430 -9.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 -6.8230 -10.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -9.3960 -5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -9.6820 -6.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -9.0670 -4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -4.5750 -7.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -5.4420 -7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -3.7510 -6.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 M END