PUBCHEM-ZINC02611584 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.7750 1.0760 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 0.8020 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 1.3760 3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 3.5870 2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 3.0800 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 3.3000 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 4.6560 5.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 4.7380 6.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 5.7160 5.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 7.0770 5.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 7.5500 6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 8.9840 6.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 9.4170 6.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 9.7850 5.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 10.7830 5.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 9.3620 5.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 10.2020 5.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 7.9750 5.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 7.5260 4.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 7.0470 6.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4070 8.1420 6.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 7.7590 8.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 0.0310 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 1.1650 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 1.6640 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 0.8480 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -0.2320 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 1.2170 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 0.8030 4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 4.6380 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 3.5590 2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 3.6130 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 3.1920 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 2.6240 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 3.3510 5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 5.4560 5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 6.9390 6.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 8.3510 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 6.7430 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 6.6510 5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 6.2560 6.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1840 7.3820 7.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 6.9980 8.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 8.6400 8.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 1.6080 1.3760 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3850 1.5080 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 2.8060 4.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 45 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 47 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 47 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END