PUBCHEM-ZINC05792655 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.0420 1.4520 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.5720 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -0.3630 2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -0.9090 3.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -1.6860 3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -1.8980 3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -1.3330 1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -2.6900 3.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -3.0120 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.9340 4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -2.3440 4.9830 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8130 -2.4130 6.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.8930 7.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -4.0440 6.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -3.7570 6.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.7980 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -2.0050 -0.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -0.2520 -2.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -1.1150 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -0.3320 -4.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -1.2330 -5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -1.7020 -6.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -2.4850 -5.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -1.5840 -3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.8420 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 1.7040 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.8930 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 0.2370 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -0.7410 3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -1.4900 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -3.1160 5.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.4250 6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -3.1520 8.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -2.0980 7.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -3.1940 6.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -4.6890 5.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 0.7110 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -1.9810 -3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 0.0020 -4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 0.5340 -4.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -2.0990 -5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -0.6750 -6.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -2.3430 -7.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -0.8360 -6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -3.3500 -4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -2.8190 -5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -0.7180 -3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -2.1420 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 17 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 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 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M CHG 1 12 1 M END