PUBCHEM-ZINC01088792 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.3520 1.7170 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 0.2290 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -0.3340 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -1.8150 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -2.6740 0.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2040 -2.1090 -0.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1090 -2.1430 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -0.6010 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -2.9290 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -3.7140 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 -4.4770 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 -4.4600 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -3.6890 1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -2.9290 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 -5.2550 0.8520 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5320 -5.7970 -0.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3780 -5.3370 2.0220 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3800 -4.0960 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -4.4590 -1.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -4.8990 0.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -6.2230 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -6.8560 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -7.4930 2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -8.0560 3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 -7.9820 2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -7.3420 1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -6.7770 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -2.6270 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -3.3280 2.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 2.2550 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 2.0040 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 2.0520 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 0.2940 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -2.1320 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -1.9720 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -0.4270 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -0.2270 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -3.7470 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 -5.0740 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 -3.6620 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 -2.3350 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -4.4880 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -6.8320 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -6.1590 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -7.5400 2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -8.5430 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -8.4130 3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -7.2720 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 -6.2670 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 -1.9110 2.5680 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