IBS-ZINC02253286 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3900 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 1.1780 -0.6880 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 2.1050 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 2.1280 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 1.4860 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 0.0180 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -0.6480 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 -0.3360 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 0.8270 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 1.8780 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 0.8880 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 1.9970 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3230 1.7720 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6770 0.5260 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3020 -0.4510 0.2940 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -1.6410 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 -2.0950 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 -3.3810 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5520 -4.2220 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8360 -3.7690 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 -2.4770 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6280 -4.5770 2.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 -5.9810 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 -6.1780 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0500 -5.4890 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9090 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -1.7680 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 3.1840 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5340 2.9540 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0490 2.5470 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6970 0.1830 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4200 -1.4430 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3180 -3.7330 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -2.1220 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 -6.4880 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9990 -6.3860 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 -5.7670 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3110 -7.2400 0.9470 H 0 0 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 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 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 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M END