PUBCHEM-ZINC06071165 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 0.5710 1.5120 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 0.0260 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -0.7200 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -2.1100 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -2.7740 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -2.0320 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -0.6430 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -4.2290 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -5.0220 0.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -6.2790 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -6.2760 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -4.9630 -1.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -4.4400 -2.6050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1440 -3.3920 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -4.6260 -3.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2580 -5.6170 -2.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -4.7200 -4.6900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3670 -5.2120 -5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -5.4460 -4.7290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3950 -5.1090 -5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -5.1220 -3.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -6.9640 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -7.6450 -4.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -7.2670 -3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -3.3890 -5.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -2.9040 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -3.5450 -2.9960 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0500 -7.3340 -1.7470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -9.5040 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -8.4730 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -8.5980 0.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -7.5380 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -7.6870 2.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -9.6040 -1.8810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 1.9950 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 1.7490 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 1.9370 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -0.2290 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -2.6680 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -2.5370 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -0.0880 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -7.2610 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -7.3150 -4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -9.5120 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -10.5190 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 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 25 26 1 0 0 0 0 28 30 2 0 0 0 0 29 31 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 34 44 1 0 0 0 0 34 45 1 0 0 0 0 M CHG 1 27 -1 M END