IBS-ZINC05556589 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0980 -1.3340 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -2.7340 3.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -3.7820 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -2.9270 2.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -3.7400 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -3.8670 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -4.6920 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -5.3990 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -5.2690 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -4.4380 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -6.2860 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -7.0310 -2.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -7.8460 -3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -8.6510 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -9.4630 -4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -9.5070 -5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 -8.7370 -4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -7.8920 -3.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 -7.0720 -3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -6.3040 -2.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -7.0760 -3.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 -6.3420 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 -5.1830 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8160 -4.4350 -1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1350 -4.8380 -2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4660 -5.9960 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -6.7460 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8020 -6.4040 -2.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7850 -5.4840 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5080 -4.3060 -2.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2270 -5.9180 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -1.1870 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -0.5880 3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -1.2300 4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -2.8380 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -3.6340 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -3.6780 5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -4.7790 3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 -3.3200 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -4.7910 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -5.8150 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -4.3340 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -8.6270 -3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -10.0820 -5.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -10.1590 -6.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -8.7800 -5.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -4.8660 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 -3.5350 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9100 -4.2520 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7260 -7.6440 -3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0200 -7.3490 -2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5680 -5.9480 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8360 -5.2110 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3210 -6.9100 -3.2490 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 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END