IBS-ZINC05346674 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 1.5490 1.3080 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -0.0970 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.6990 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -1.9870 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.6800 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -2.0740 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.7780 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7680 -2.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -2.0770 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -2.7630 -4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -4.1240 -5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -4.1920 -6.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -2.9000 -7.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -2.0050 -6.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -0.6760 -5.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -0.0800 -4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -0.7490 -3.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -2.5800 -8.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -3.3690 -9.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -3.0520 -10.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -1.9480 -11.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -1.1590 -10.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -1.4750 -8.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -3.9470 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 1.2760 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 1.8010 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 1.8620 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -0.1610 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.4550 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -0.3040 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -3.7350 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -4.9660 -4.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 0.9990 -4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -4.2310 -9.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -3.6650 -11.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -1.7010 -12.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -0.2980 -10.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -0.8620 -8.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -3.9960 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 33 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END