IBS-ZINC02306870 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 -1.8850 2.2000 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 0.8960 0.6160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -0.0940 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -1.1460 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -0.7870 -0.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 0.4200 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 1.0930 -1.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 0.2860 -2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 1.0350 -4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 2.3380 -4.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 3.1450 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 2.3960 -1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 3.0180 -5.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 4.2760 -5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 4.9420 -6.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 4.3250 -7.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 3.0760 -7.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.2830 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -2.3570 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -3.3630 3.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -1.3460 3.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -0.2140 2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 0.6960 3.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.4760 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -0.7920 5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 0.5220 5.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 1.1500 5.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 0.4650 5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -0.8490 5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -1.4800 5.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -3.1330 4.5880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -3.4070 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 2.9300 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 2.5220 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 2.1190 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 0.1090 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -0.6690 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 0.4510 -5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 1.1880 -4.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 4.0990 -3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 3.3220 -2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 2.9800 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 2.2430 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 4.7260 -5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 5.9190 -7.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 4.8190 -8.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 2.5930 -7.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -1.0120 5.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -2.5320 5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 1.0580 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 2.1770 6.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 0.9570 6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 -1.3840 5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -3.2790 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.3380 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -3.4390 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 2.4610 -6.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 57 2 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 M END