PUBCHEM-ZINC06409398 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -1.2170 1.7570 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 0.2160 -0.3190 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0710 -0.1700 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -0.0870 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -1.5390 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -1.7130 2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -2.3180 3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -2.6370 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -1.6720 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -2.5530 0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -2.0990 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -1.4170 -1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -0.3900 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 0.0660 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.4020 -4.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -1.3550 -4.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -1.8590 -3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -3.8670 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -4.3180 1.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -4.8210 -0.8500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1540 -4.2560 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -5.5990 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -6.5780 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -7.5450 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -6.8090 -2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -5.8160 -0.9590 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4640 -6.3780 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -5.1500 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -3.9550 -1.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 2.2010 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 2.0840 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 2.1900 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 0.1890 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 0.5920 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -0.7470 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -2.3050 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -1.5850 4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -3.2060 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -2.5100 4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -3.6730 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -2.0200 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -0.7070 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -1.4440 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -2.9500 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 0.7920 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -0.0250 -4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -1.7300 -5.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -2.6380 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -4.9190 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -6.1510 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -6.0210 -2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -7.1420 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -8.1830 -2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -8.2060 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -6.2780 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -7.5470 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -5.8970 -1.0380 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 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 48 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 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 M CHG 1 57 -1 M END