IBS-ZINC05556489 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 0.0180 1.3970 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 0.0130 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -0.5400 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 0.7240 -0.0250 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 1.9690 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.0200 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5810 -2.5680 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -2.3900 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -3.8330 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -4.5440 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -5.8850 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -6.4340 1.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -5.7300 2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -4.4580 2.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -6.3450 3.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -7.6370 3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -8.2620 2.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 -8.2360 4.6620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -9.6020 4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 -10.1830 3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 -11.5310 3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 -12.3030 4.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -11.7260 5.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -10.3770 5.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 -13.9970 4.7740 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -3.8900 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -4.5320 -2.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -2.3840 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 1.9710 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -0.5750 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 3.0330 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -1.7610 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -2.2160 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -6.4590 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -5.8460 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -7.7200 5.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 -9.5820 2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 -11.9840 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -12.3300 6.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -9.9260 6.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -2.0670 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -1.9010 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END