PUBCHEM-ZINC06079658 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0820 1.4800 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.0190 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.7460 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -2.1350 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -2.7640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.1080 -1.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7430 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.0450 -2.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2360 1.0130 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.1160 -3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 1.0130 -3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 0.9100 -3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 2.0230 -3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 1.8870 -4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 0.6430 -4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2870 -0.4610 -4.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -0.3540 -4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -1.4470 -4.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -1.3140 -3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 0.1680 -4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -0.4050 -5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -1.1530 -3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -0.5590 -2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 1.8940 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8710 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 1.8420 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -0.2330 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -2.7080 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -3.8480 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 1.9750 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 3.0020 -3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 2.7470 -4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1470 0.5270 -5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -1.4300 -4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -2.2370 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 1.2290 -4.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.1170 -5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -1.4360 -6.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 0.2110 -6.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -1.0470 -3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -2.2080 -4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -1.1560 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 0.4670 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -0.5760 -3.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -0.4200 -5.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0500 -0.8600 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 0.5450 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 44 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 45 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END