IBS-ZINC00540217 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.7630 1.5380 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 0.0830 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.7630 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -0.7200 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -1.8730 3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -3.1260 2.2800 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.0110 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -1.9240 -0.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -0.6130 -0.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -2.9640 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -2.6960 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -3.7240 -2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -5.0200 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -5.2910 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -4.2660 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -2.0620 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -1.1030 5.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -3.2960 5.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -4.4890 4.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -5.3870 4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -5.6910 6.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -4.3860 7.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -3.4760 6.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0240 -3.9340 7.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.1180 7.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 1.6250 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 2.0510 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 1.9910 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 0.1800 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -1.6840 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -3.5160 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -5.8230 -3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -6.3040 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -4.4770 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -5.0310 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -4.1880 3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -6.3190 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -4.8770 4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -6.1790 6.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -6.3500 6.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -4.6060 8.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -3.8850 6.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -1.4640 7.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.2520 8.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -1.6680 7.0190 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 9 2 0 0 0 0 3 4 1 0 0 0 0 3 7 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 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 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END