IBS-ZINC02204059 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -0.9900 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -0.6280 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 0.5920 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1510 1.3100 -4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 2.4940 -3.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 3.3830 -4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 3.0660 -5.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 1.9380 -6.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 1.0720 -5.8430 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 4.5730 -4.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 5.4940 -4.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9700 6.7190 -4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7830 7.4440 -3.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 8.6140 -3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 2.5140 -2.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 1.4050 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 1.0020 -1.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 -1.4900 -4.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -2.5300 -4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -3.2530 -3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -2.2730 -2.2290 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 0.5120 -0.3560 -0.8950 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 0.7570 -1.6010 1.2360 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 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4730 1.7180 -7.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 4.7950 -3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 5.8080 -5.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5160 4.9900 -5.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 7.3620 -4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4640 6.3980 -3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 9.1070 -2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6670 9.2960 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 8.3320 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -1.9990 -4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -0.8630 -5.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 -3.2500 -5.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -2.0340 -4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -3.5920 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -4.1060 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -2.0590 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -2.7220 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 22 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 21 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 M END