PUBCHEM-ZINC06145836 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 0.1390 0.3360 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -0.0290 0.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -0.6400 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -1.1420 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -1.7970 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -1.9450 3.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -1.4330 2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -0.7850 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 -2.6250 4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -4.0070 4.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -4.1730 5.6040 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9170 -5.1780 6.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -6.5620 6.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -7.2480 7.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 -6.5720 8.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 -5.1720 8.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 -4.4950 7.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 -3.1190 7.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -2.3710 7.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -3.0310 6.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -2.0230 5.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -0.6070 5.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 0.0030 6.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 1.4830 6.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 3.6760 7.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 4.3170 7.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 3.8330 8.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 2.4210 8.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 1.6680 8.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -0.5340 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 0.7310 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 1.1270 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -1.0320 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -2.1860 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -1.5390 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -0.4090 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -4.8540 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -7.0710 5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -8.3380 7.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -7.1600 8.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 -4.6460 9.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 -0.4850 6.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -0.0980 4.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -0.1230 5.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -0.5500 7.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 1.6360 7.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 2.0070 5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 3.9990 6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 3.8920 7.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 5.4010 7.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 4.1280 6.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 2.1190 9.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 2.1910 8.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 1.8640 9.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 0.5960 8.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 2.1520 7.1870 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3770 1.9430 6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 11 1 M CHG 1 56 1 M END