IBS-ZINC01250085 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0980 1.8160 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.3240 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -0.1320 0.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -0.5040 0.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -1.9540 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -2.4950 1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -2.9070 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -3.4030 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -3.4860 4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -3.0740 3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.5830 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 0.0470 0.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0000 -0.7550 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 0.9250 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 2.2930 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 3.2910 1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 2.2260 -0.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 1.0080 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 0.7210 -2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 3.3370 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 3.3800 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 4.4760 -3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 5.5300 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 5.4910 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 4.3990 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 6.8160 -2.0910 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 2.3170 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 2.1320 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 2.0780 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -2.4210 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -2.1760 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -2.8420 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -3.7250 3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -3.8730 5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -3.1390 4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -2.2640 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 0.5620 1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 0.9520 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4380 2.5570 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 4.5090 -4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 6.3860 -3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 4.3710 -0.6500 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 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 20 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 M END