PUBCHEM-ZINC05320176 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.0490 1.7880 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.2840 0.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7530 -0.0570 1.3780 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2950 0.5240 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -1.5430 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -2.5280 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -2.0700 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -0.5660 -1.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1670 -0.3420 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -0.1680 -1.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2490 0.8520 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -0.2140 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 0.3140 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -1.0010 -3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -1.9010 -4.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 -1.5500 -4.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 -1.5530 -3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -0.6380 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -1.2660 -6.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -0.3040 -6.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 -0.0140 -7.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 -0.6850 -8.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -1.6430 -8.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -1.9240 -7.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -0.0890 0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 2.2180 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 1.9850 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 2.3430 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -1.7970 2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -1.6900 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -2.7250 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -3.4980 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -2.7060 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -2.2720 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -1.2300 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 0.3910 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 1.4080 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -0.0270 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 0.0450 -3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -1.3650 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -2.9530 -4.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -1.7810 -5.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -2.5800 -3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 -1.2550 -3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8970 -0.7490 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 0.4110 -2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 0.2660 -5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2910 0.7410 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -0.4640 -9.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 -2.1790 -9.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -2.7010 -7.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 0.3880 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -1.0320 -2.3050 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9030 -2.0060 -1.9750 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 8 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 53 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END