IBS-ZINC02118903 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 0 0 0 0 0 0999 V2000 0.1400 1.1650 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.2220 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -0.8310 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 0.0020 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 1.3920 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 1.9830 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 1.9090 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 3.2060 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 3.2930 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4540 2.2340 0.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9670 0.9740 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 0.8180 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -0.3150 -0.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 -1.2590 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 -0.1210 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1680 -0.1040 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 -1.1220 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7780 -2.1640 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5490 -2.2070 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6180 -1.1880 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 -3.1370 1.0010 F 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 4.6220 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 5.6620 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 4.5310 0.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 5.6580 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7700 5.4440 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7510 6.5800 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2050 7.1270 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5480 6.7360 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5190 6.8700 -1.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5300 6.0180 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1310 6.3680 -1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 1.6190 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -0.8410 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -1.9120 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 3.0640 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 4.0880 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 0.7140 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0620 -1.1070 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -3.0250 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 -1.2220 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 3.5810 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 6.5820 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6560 5.7240 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2160 4.4880 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5480 5.3600 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4110 7.5320 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9100 6.7000 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2070 6.9660 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9440 8.1650 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3330 7.3970 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8240 5.7080 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5730 6.1570 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7810 4.9720 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8640 7.4010 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3900 5.6760 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1030 6.2540 -0.2630 N 0 3 0 0 0 0 0 0 0 0 0 0 12.3240 5.2790 -0.0160 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END