IBS-ZINC02281794 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 0 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 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0730 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7710 -2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -3.6110 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -4.2920 -3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -5.0960 -4.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -4.2550 -3.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -3.5750 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -5.7850 -5.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -6.6160 -5.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -7.2860 -6.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -8.0750 -6.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -8.9330 -7.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -9.5410 -7.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 -9.2990 -6.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -8.4520 -5.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -7.8310 -5.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -6.9530 -4.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -6.6220 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 -10.3790 -8.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 -10.9740 -8.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -7.1120 -7.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -6.3200 -7.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -5.6650 -6.1130 N 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 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8530 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2700 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5190 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0180 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -2.9910 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -4.3700 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -3.5330 -4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.9380 -4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -3.4960 -4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -4.8750 -4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -4.3330 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -2.9280 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -9.1220 -8.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 -9.7780 -6.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -8.2710 -4.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5260 -10.1910 -8.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -11.6170 -9.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 -11.5670 -7.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -6.1990 -7.9200 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 7 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 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 30 2 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 M END