PUBCHEM-ZINC05932953 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -6.2830 1.4050 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 1.7090 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 0.5640 -0.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0910 0.3920 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -0.7070 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -0.4600 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -0.0180 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 1.2280 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 0.9190 0.3430 N 0 3 3 0 0 0 0 0 0 0 0 0 -2.5660 -0.2080 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 2.3320 1.3850 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 1.6240 2.9340 N 0 3 3 0 0 0 0 0 0 0 0 0 -2.5710 0.9100 3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 0.2260 4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 1.2860 5.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 2.0730 5.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 2.6880 3.8490 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3130 3.3590 4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 3.4760 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 4.6740 4.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 0.6810 2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6670 2.2590 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 0.5270 -2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 1.2120 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 1.8130 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 2.6370 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -1.5240 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -0.9690 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -1.3800 -2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 0.3210 -2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -0.8200 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 0.2130 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 1.5460 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 2.0290 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -1.0910 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 0.0430 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 -0.4130 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 0.1590 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 1.6190 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 -0.4830 4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -0.3010 5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 0.7990 6.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 1.9650 6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4640 1.4020 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 2.8650 5.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 3.8300 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 2.8310 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 4.3260 5.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 5.3620 4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5180 5.1850 3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -0.3340 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 0.7510 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 0.9250 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 M CHG 1 9 1 M CHG 1 12 1 M END