IBS-ZINC02368552 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -1.2540 1.1890 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -0.1550 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.7060 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -1.9450 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -2.6250 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.0750 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -0.8430 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -0.1590 -2.5120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0150 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.6950 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.9070 3.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 0.0520 4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -1.1310 6.2490 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -0.0180 7.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 1.2960 7.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.7960 8.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 0.8330 9.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -0.3580 8.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -1.7090 9.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -2.1600 9.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -2.5660 11.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 0.9960 11.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 2.2770 11.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 2.4130 13.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 1.2650 13.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 0.0260 13.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.0770 11.8600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.9740 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 1.2310 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 1.3330 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -2.3760 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -3.5880 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6080 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.9540 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 0.6900 5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 0.6670 4.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -1.7050 10.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -2.3920 8.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -2.1500 9.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 -2.8890 11.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -2.5760 11.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 3.1490 10.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 3.3910 13.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.3380 14.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -0.8680 13.7740 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 M END