PUBCHEM-ZINC01088791 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.9390 1.4600 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 0.0250 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -0.3300 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.7530 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -2.8370 -0.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2490 -2.4150 0.2080 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2300 -2.3060 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -0.9980 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -3.4430 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -4.1840 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -5.1320 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 -5.3480 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 -4.6260 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -3.6790 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4450 -6.3370 -0.7020 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9830 -6.8410 0.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 -6.6090 -1.8720 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5920 -4.1300 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -4.4230 1.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -4.8810 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -6.0750 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -6.6690 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 -6.3570 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -6.8880 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 -7.7290 -1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 -8.0370 -2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -7.5060 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -2.9370 -1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -3.5310 -1.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 2.1440 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 1.6120 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 1.7390 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 0.4340 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -1.8390 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -1.9090 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -0.6700 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -1.0010 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -4.0350 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -5.6860 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 -4.7780 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -3.1290 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -4.5340 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -5.8280 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -6.7960 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -5.6900 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 -6.6370 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 -8.1350 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -8.6810 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -7.7380 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -2.4280 -2.5220 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 50 -1 M END