IBS-ZINC05322404 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.9760 1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -2.7520 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -4.1000 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -5.1300 0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 -4.7860 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 -5.7760 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3220 -5.4100 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 -4.0640 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -3.0800 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -3.4150 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -2.4610 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -4.0550 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -2.7990 1.8140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -5.1570 2.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -4.9700 2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -3.8460 2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -6.1580 3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -5.6730 3.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -6.8790 4.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 -6.4000 5.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 -5.2160 5.2880 O 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -6.1630 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 -6.8210 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -6.1710 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 -3.7990 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 -2.0430 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -6.0560 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -6.7630 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -6.7580 3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -5.0680 4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -5.0720 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -7.4840 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -7.4790 5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7420 -7.2900 5.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5170 -6.9350 6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 32 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 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 44 45 1 0 0 0 0 M END