PUBCHEM-ZINC05905562 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7370 -2.5260 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 -2.5940 0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2700 -2.0070 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -2.4020 -1.3330 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5920 -2.3100 -1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 -2.3560 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9580 -2.2280 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0490 -2.0600 -2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9250 -2.0120 -3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -2.1380 -3.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -2.1350 -3.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -2.0380 -4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -2.2940 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -2.3330 -2.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.6650 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -3.3950 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -4.0530 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -4.4470 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -5.7830 1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -6.7310 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -6.3330 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -4.9950 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -8.0460 1.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 -2.4870 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8660 -2.2590 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0250 -1.9650 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -1.8820 -4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -2.1460 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -3.6320 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -3.7570 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -3.7090 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -6.0910 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -7.0680 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -4.6850 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -8.5180 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 21 37 1 0 0 0 0 21 38 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 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M CHG 1 9 1 M END