IBS-ZINC04137065 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0100 1.3140 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.0740 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -0.7280 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 0.0650 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 1.4560 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 2.0900 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 1.9250 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 0.8070 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -0.2970 -0.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 -1.2490 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 0.6890 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -0.1070 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 -0.1660 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7810 0.5620 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 1.3250 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6980 1.4010 -1.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 3.3570 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 3.7690 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 5.2120 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 5.6850 2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 4.9480 3.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 1.8050 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.6600 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -1.8100 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 3.1720 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 -0.6520 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6300 -0.7680 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8640 0.5410 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 1.9140 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 3.5170 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 4.0070 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 3.6450 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 3.1030 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 5.3310 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 5.8860 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 6.7800 3.0200 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 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 25 1 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 M CHG 1 36 -1 M END