IBS-ZINC05100856 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0410 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -2.7460 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -4.1550 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -4.7750 2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -4.8310 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -4.1910 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -2.7840 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -2.1170 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.8350 -3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -4.2290 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -4.9050 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -6.4110 -2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -8.3650 -2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 -8.8380 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -7.0740 -3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 -6.6000 -3.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -9.0270 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -4.9290 -4.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -2.0070 -5.1600 Cl 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -2.2280 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -1.0370 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -6.7820 -3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -6.7540 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -8.5740 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -8.8900 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -9.9160 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -8.3340 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -6.5490 -3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -6.8640 -4.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -7.1050 -4.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -5.5230 -3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6240 -8.5700 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 -10.1100 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4220 -8.7780 -4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -5.1210 -5.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -6.9190 -2.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6370 -8.5200 -3.5580 N 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 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 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 11 12 1 0 0 0 0 11 31 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 21 1 0 0 0 0 14 15 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 46 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 47 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 46 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 47 1 0 0 0 0 21 45 1 0 0 0 0 M END