PUBCHEM-ZINC05890664 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.0500 1.9030 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 0.5380 0.4430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7980 0.5830 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -0.5530 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -1.9320 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -2.2660 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -1.1790 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 0.2120 -0.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5170 0.9770 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 0.2250 0.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 0.8220 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 0.9250 -0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 1.5350 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 2.0400 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 1.9360 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 1.3160 1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 1.1920 2.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 2.4460 2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3710 3.0800 2.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9630 3.2750 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6540 3.4060 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7390 4.0400 4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6710 4.1980 6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 3.7640 6.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5190 3.1120 6.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 2.9420 4.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 2.3520 3.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 3.9780 8.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4510 3.9660 9.0190 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5540 3.8440 8.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 4.1090 10.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7130 4.7840 6.7080 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 2.1580 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 2.6890 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 1.9170 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -0.3300 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -0.5700 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -1.9640 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -2.6930 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -3.2250 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -2.3910 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -1.1620 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -1.4460 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 0.5240 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 1.6090 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9940 2.5050 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 1.5890 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5950 4.3910 4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 2.7120 6.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7190 4.1920 8.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5880 4.2500 8.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7660 4.3400 9.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 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 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 29 1 M END