PUBCHEM-ZINC06908538 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.3380 0.8280 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.3120 -0.7200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2490 -1.2390 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -0.4140 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.4000 0.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -0.5770 -1.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 -0.6600 -1.6930 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1130 -1.1980 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4040 0.7260 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3200 1.5830 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 2.7100 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 3.4870 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 3.1340 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 2.0230 1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 1.2510 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 3.9020 2.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 3.3790 3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -1.4070 -2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -1.4850 -3.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -0.2810 0.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -1.5010 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -2.5670 0.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -1.4890 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -2.6610 2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 -2.6190 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -1.4100 4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -0.2410 4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -0.2880 3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 0.8680 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 1.7490 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 0.9170 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 1.9970 0.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 1.0220 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.5720 -2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.7560 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -0.6910 -2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 1.2650 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 0.6310 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 2.9800 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 4.3490 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 1.7410 2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 0.3780 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -3.6050 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -3.5280 4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -1.3800 5.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 0.6920 4.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -1.8400 -3.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 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 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 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 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 M CHG 1 47 -1 M END