ASINEX-ZINC04170666 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.7470 0.0080 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 1.4430 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 2.0950 -0.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 2.0230 -1.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1850 3.5190 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 4.0380 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 5.1930 -2.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 2.9630 -3.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 1.7490 -2.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2620 0.9530 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 1.3730 -3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 2.2390 -4.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 1.8680 -4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 0.6190 -5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -0.2580 -5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 0.1250 -4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -1.4640 -5.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.5710 -5.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 0.1700 -6.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 0.8820 -6.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 3.0480 -4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 3.7580 -5.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 4.4670 -7.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 4.9310 -8.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 6.1170 -8.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9780 5.8990 -7.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0310 5.4910 -6.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 4.2410 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -0.6370 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -0.3030 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -0.0880 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 3.2140 -3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 2.5790 -5.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -0.5440 -4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -2.5520 -4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -2.6070 -5.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -3.4850 -5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 1.8680 -6.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 0.9640 -5.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 0.3160 -7.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 2.0410 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 3.6000 -4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 4.6370 -5.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 3.0600 -6.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 3.5260 -8.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 5.2330 -7.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 5.1620 -9.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 4.1490 -9.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4800 6.8350 -7.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7520 5.1400 -7.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 6.2630 -6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5880 5.2780 -5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 1.6430 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 4.2230 -6.6140 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9630 3.4740 -6.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 28 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 21 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 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 35 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 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END