PUBCHEM-ZINC06092495 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 0 0 0 0 0 0999 V2000 -0.2570 1.1140 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.2510 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -0.7170 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 0.2140 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 1.5830 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 2.0290 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 2.3650 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 3.7730 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 4.4280 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 5.9420 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7070 6.5850 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 8.1000 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 8.6090 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1460 9.9590 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 10.8920 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 12.2470 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 12.6760 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8010 11.7530 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4640 10.3950 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1900 12.1940 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4470 13.1910 0.9430 N 0 3 0 0 0 0 0 0 0 0 0 0 9.6950 13.6340 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3870 13.5260 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -2.1520 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -2.8430 1.0060 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0410 -2.3830 1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -3.8310 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 1.4670 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.9420 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 -0.1140 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 3.0810 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 3.9810 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 4.1690 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 4.1820 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 3.9910 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 6.1740 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 6.3680 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1140 6.3580 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4170 6.1580 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 8.3300 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 8.5350 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 10.6000 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 12.9700 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0110 13.7360 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2250 9.6540 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1570 11.5820 -0.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9400 10.8340 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1270 11.8480 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -2.7220 -0.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -2.1810 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -3.7040 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 M CHG 1 21 1 M CHG 1 25 1 M END