IBS-ZINC05561595 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7040 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0830 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7240 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9890 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6530 -1.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.9040 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.1870 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.0780 -0.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -2.5760 -3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -3.1640 -4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -2.8540 -5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.9620 -6.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -1.3760 -5.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -1.6820 -4.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.8040 2.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.1050 3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -3.1140 4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -3.5610 5.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -4.4870 6.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -4.9660 6.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -4.5190 6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -3.5900 5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1730 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -5.1140 -2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -3.8600 -4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -3.3090 -6.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -1.7230 -7.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -0.6800 -5.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -1.2270 -3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -3.7730 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -1.4680 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -1.4920 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -3.1870 4.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -4.8360 6.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -5.6900 7.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -4.8930 6.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -3.2370 4.9060 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 17 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 2 0 0 0 0 9 29 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 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 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 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END