PUBCHEM-ZINC01845202 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0950 1.0020 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 0.5130 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 0.2260 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 0.4320 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 0.9160 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 1.2010 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 0.1020 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -1.3270 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7200 -1.6600 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6340 -0.8740 -1.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -2.9320 -1.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2090 -3.5270 -2.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8490 -3.3680 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8720 -2.8980 -3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0330 -3.0480 -4.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6710 -2.6050 -5.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 -3.0060 -7.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8170 -2.1870 -8.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 -2.5760 -9.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 -3.7900 -9.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 -4.6180 -8.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1680 -4.2320 -7.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1060 -5.0540 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -5.5180 -2.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 1.2220 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 0.3500 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -0.1630 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 1.0660 -2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 1.5730 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 0.8170 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 0.2520 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -2.0430 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -1.4710 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -3.5720 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 -1.8280 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 -3.3650 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -1.5150 -5.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6650 -3.0580 -5.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3510 -1.2400 -8.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -1.9320 -10.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -4.0930 -10.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 -5.5670 -8.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 -4.8890 -6.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1990 -5.6560 -2.6910 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 M CHG 1 44 -1 M END