PUBCHEM-ZINC05603565 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.2080 2.1100 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 0.7540 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -0.0780 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 0.4450 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 1.8010 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 2.6330 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -0.4620 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -1.0000 -1.4630 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2220 -0.1660 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -1.8130 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 -2.9840 -1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 -1.2390 -0.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 -2.0160 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8570 -3.0660 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9800 -3.8300 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7780 -3.5510 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4560 -2.5060 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 -1.7340 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9810 -4.3720 0.2260 N 0 3 0 0 0 0 0 0 0 0 0 0 11.2650 -5.2930 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6850 -4.1270 1.1890 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9710 -1.8460 -2.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -1.9800 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 -1.4750 -4.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -2.7570 -3.9450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4640 -3.6090 -3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -1.8440 -4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -1.3580 -5.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.4390 -6.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -2.5870 -7.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -3.2120 -5.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 2.7590 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 0.3450 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -1.1380 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 2.2100 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 3.6930 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 0.0980 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -1.2950 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 -0.2880 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2330 -3.2850 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2340 -4.6470 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0820 -2.2900 1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 -0.9150 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -2.3090 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -2.4100 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -1.0060 -3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -1.2710 -6.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -0.4040 -5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -3.9720 -5.5000 H 0 0 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 49 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END