IBS-ZINC04089072 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 1.4860 1.2990 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 0.3550 -2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -0.2900 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 0.0470 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 0.9860 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 1.6230 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 1.0740 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 0.1900 1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -0.4160 1.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -1.1050 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 1.9550 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 3.3500 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0830 4.2420 1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 3.8890 1.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 5.4770 2.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 6.5730 2.7940 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3370 6.6930 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 6.3070 4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 6.2040 3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6430 5.0410 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9640 5.3620 3.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7070 4.7000 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1400 6.7190 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8780 7.2770 3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7810 8.6760 4.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9390 9.4600 3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1830 8.8720 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3080 7.4890 3.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 7.8950 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 7.7260 3.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 1.7910 -3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 0.1170 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -1.0230 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 2.3630 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -0.0520 2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 1.4900 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 2.0230 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 3.8280 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 3.2880 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 5.7410 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 7.0820 4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 5.3710 4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3110 4.0140 3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 9.1470 4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8590 10.5380 4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0700 9.4990 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2780 7.0340 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5570 8.9590 3.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 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 8 35 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 M CHG 1 48 -1 M END