IBS-ZINC05551602 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 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 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -3.1410 -3.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -3.9970 -4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -4.4640 -5.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -4.4230 -5.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -5.0220 -6.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -5.4820 -7.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -5.1420 -6.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -5.3140 -6.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.8600 -6.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -4.2140 -4.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -6.1730 -8.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -7.0670 -8.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -7.7470 -9.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -7.5380 -10.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -6.6490 -10.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -5.9620 -9.3370 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 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -3.9720 -4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -5.0180 -6.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 -7.2310 -7.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 -8.4420 -9.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -8.0710 -11.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -6.4890 -11.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -5.2640 -9.2350 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 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 18 2 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 35 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 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 M END