CHEMDIV-ZINC07000456 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 0.9760 2.0260 4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 0.6480 4.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.2360 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -1.5760 3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -2.5920 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -2.2450 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -0.9120 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 0.0940 2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -0.7340 0.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 0.5980 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -3.9660 2.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -4.5440 4.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -3.9220 4.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -6.0100 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -6.9100 3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -8.1820 3.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -8.1370 4.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -6.8490 4.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 -6.5000 5.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 -5.5720 5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 -4.4110 6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 -4.8500 7.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -6.0220 6.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 -9.3380 4.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -10.5740 4.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -11.7700 4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 -11.7310 4.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -10.5200 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 -9.3200 4.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 -12.8770 4.5420 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 2.2070 4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 2.5870 4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 2.3930 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -1.7840 4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -3.0090 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 1.1270 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 1.0360 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 1.2190 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 0.5600 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -4.5750 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -6.7050 2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 -7.4030 6.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 -6.1710 5.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -5.1610 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 -4.7090 6.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 -3.5940 5.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -4.3310 8.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -5.1480 8.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -5.7590 6.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -6.8660 7.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -10.6220 3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -12.7250 4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -10.5170 4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -8.3990 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -3.8820 6.7720 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1760 -2.9730 7.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -3.6960 6.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 55 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 M CHG 1 55 1 M END