PUBCHEM-ZINC02545940 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.7270 1.4810 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 0.2240 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 0.5270 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -0.7980 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -0.4360 -0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 0.1850 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 1.3070 -0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -0.6620 -1.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -0.3260 -2.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4610 0.6430 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -0.1920 -3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 0.9300 -4.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 0.8260 -4.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 2.0680 -5.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 2.2830 -5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 2.9920 -5.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 2.3080 -4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 3.0380 -4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 4.4140 -4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 5.0670 -4.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 4.3680 -5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 -1.3930 -1.7580 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9280 -2.3680 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 -1.5050 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 -2.5750 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 -2.6330 -0.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 -1.0630 -2.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0950 -1.7000 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 2.2720 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 1.2590 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 1.8890 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 0.8740 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -0.3650 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 1.3020 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -1.0700 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -1.7290 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -0.4140 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -1.5650 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 -0.0290 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -1.1340 -4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -0.0290 -4.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8030 2.5390 -3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 4.9770 -4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 6.1370 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 4.8790 -5.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 -0.5590 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -1.7640 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -3.2470 1.2070 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 48 -1 M END