IBS-ZINC02132052 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.8270 1.4240 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -0.0950 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.5920 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.1230 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -2.6540 -2.2720 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8530 -2.2760 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -4.1890 -2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -4.9190 -2.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -4.6500 -1.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -6.0690 -1.1170 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3000 -6.6440 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -6.6120 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -8.1000 -1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -6.4290 -3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -6.1880 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -5.1530 0.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -2.2380 -3.6090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -2.3250 -3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -1.9520 -5.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -1.4420 -6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -1.0290 -7.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -0.5280 -8.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -0.4350 -8.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -0.8430 -6.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -1.3430 -5.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -1.7760 -4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -1.7080 -4.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 1.8280 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 1.8480 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 1.7580 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -0.4870 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -0.4670 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -0.1850 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -0.2150 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -2.5090 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -2.5070 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -4.0180 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2350 -6.0580 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -8.6990 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -8.4830 -2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 -8.2680 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -5.3710 -3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -6.8770 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -6.9030 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 -2.7530 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -1.1020 -7.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -0.2120 -9.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -0.0470 -8.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -0.7680 -6.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -7.2620 0.9510 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 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 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 50 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 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 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 50 -1 M END