PUBCHEM-ZINC04556772 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 1 0 0 0 0 0999 V2000 1.4900 -0.9790 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -0.1960 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 1.1380 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 1.9490 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 3.1680 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 1.2690 0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -0.1330 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -0.8900 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -2.2770 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.8690 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -2.0890 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -0.7070 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 -2.7570 0.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 -2.1740 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 -0.9740 0.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2370 -3.1880 0.5620 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1840 -3.8750 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1730 -3.9590 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4760 -2.4150 0.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6830 -2.9840 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8470 -4.1800 -0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8780 -2.0260 0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.5920 -1.1030 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4000 -1.7500 1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5480 -0.7340 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9390 -0.4380 3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0910 0.5560 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.3290 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -1.6780 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -1.5430 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 1.7050 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -2.9280 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -3.9520 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -0.0440 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -3.7670 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2110 -3.2790 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0120 -4.6560 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2460 -4.5370 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3680 -1.4140 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7220 -2.6920 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5700 -1.3800 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2440 0.1970 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4240 -1.1170 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2220 -1.3740 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0680 -0.0410 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8310 1.5230 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0000 0.1700 2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4150 0.8040 4.5270 N 0 3 0 0 0 0 0 0 0 0 0 0 -15.1930 1.4690 4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6150 1.2040 5.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6940 -0.0580 5.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9550 -2.6620 -0.7560 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.1780 -3.5950 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6020 -2.8440 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8170 -2.1110 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 52 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 52 55 1 0 0 0 0 M CHG 1 48 1 M CHG 1 52 1 M END