PUBCHEM-ZINC05957842 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -2.7450 1.1610 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.3570 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 3.3150 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 3.9650 3.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 5.3660 3.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 6.3270 3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 6.0510 2.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 7.7360 3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 8.7340 2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 10.0710 2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 10.4140 3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 9.4200 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 8.0580 4.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 7.0970 4.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 7.4380 5.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 8.7590 5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 9.7550 5.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 6.3050 6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 5.1970 5.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 4.1030 5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7100 4.0940 7.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3510 5.1770 8.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6890 6.2740 7.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 0.0770 1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 1.5030 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 1.4510 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 1.7540 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 0.2640 2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 1.7220 3.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 3.5230 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 3.6820 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 3.4870 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 3.8830 3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 5.6890 4.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 8.4740 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 10.8430 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 11.4650 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 9.0210 6.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 10.7950 5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 5.1900 4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6860 3.2620 5.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2290 3.2450 7.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5830 5.1670 9.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 7.1000 8.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 1.8060 2.6350 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3580 1.4690 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 45 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END