IBS-ZINC05462769 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0440 1.5030 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.6990 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -2.0790 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.7750 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.0710 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.6850 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.7420 -2.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -4.2600 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -5.0930 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -6.3830 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -6.2740 -0.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -7.0200 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -5.0350 -1.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -7.6290 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -7.5820 2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -8.8200 0.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -10.0000 1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -9.9780 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -11.1450 3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -12.3350 2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -12.3610 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -11.1960 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -11.2230 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -13.8580 1.1120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 1.8750 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 1.8670 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 1.8580 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.1590 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.6180 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.1380 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -2.9430 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -4.7900 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -8.8600 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -9.0490 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -11.1270 4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -13.2460 3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -11.4130 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -12.0140 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -10.2630 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 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 33 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END