IBS-ZINC05026796 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.0670 1.9380 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 0.4730 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.3370 -2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -1.8020 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -2.6120 -3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -4.0150 -3.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -4.9390 -4.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -4.6640 -5.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -5.7860 -5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -6.8400 -4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -6.2780 -3.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -6.9920 -2.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -7.5470 -3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -8.8200 -3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -9.3290 -3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -8.5660 -3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -7.2930 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -6.7850 -2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -5.1900 -2.1290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -8.1490 -5.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -9.0870 -4.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -8.3550 -6.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -7.3300 -7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -7.5540 -8.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -6.0620 -6.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -4.9710 -7.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 -9.7170 -6.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 2.3340 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 2.0090 -3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 2.5160 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 0.4030 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 0.0780 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -0.2660 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 0.0590 -3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -1.8730 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -2.1980 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -2.5410 -4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -2.2160 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -4.2920 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -7.8090 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -6.3040 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -9.4160 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -10.3230 -4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 -8.9640 -3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -6.6970 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 -4.5850 -7.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -5.3450 -8.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -4.1730 -7.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -10.1720 -7.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4510 -9.6850 -7.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -10.3080 -5.8210 H 0 0 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 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END