IBS-ZINC04043039 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0860 1.0770 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.7750 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 3.0230 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 3.4820 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 5.0120 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 5.4240 3.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 6.7680 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 7.2310 4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 8.5910 4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 8.7610 6.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 9.8790 6.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1850 9.6960 7.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4720 8.4070 8.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 7.2780 7.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0540 7.4880 6.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 6.5850 5.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 5.5840 5.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6780 10.8590 8.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5610 10.7410 9.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 9.5360 4.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 9.0190 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 7.7190 2.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -0.0090 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 1.3780 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 1.5610 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 1.1040 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -0.2970 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 0.9950 3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 3.4400 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 3.3210 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 3.0670 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 3.1110 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 5.4250 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 5.3870 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 4.7360 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 10.8800 6.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1370 8.2360 9.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 6.2810 7.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4680 10.1940 9.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0610 10.2760 10.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8590 11.7510 9.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 9.7330 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.5100 1.1780 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6590 1.2200 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 43 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 22 2 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END