PUBCHEM-ZINC00639834 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.3130 1.2170 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -0.2790 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -0.7720 0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -2.1110 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.8890 0.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 -2.5020 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -4.0110 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0850 -4.2120 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 -4.4660 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6810 -5.8180 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8030 -6.6860 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1480 -6.6010 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0080 -7.6800 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5460 -8.8310 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2160 -8.9400 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3680 -7.8530 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 -7.6910 -0.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4640 -8.3980 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6110 -6.4500 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -5.9070 -0.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5490 -6.4990 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -5.9530 -2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -4.9570 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -3.8570 -2.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -5.4280 -4.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -4.5340 -4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6350 -5.2170 -6.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 1.6400 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 1.4370 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 1.7180 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -0.7690 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -0.4830 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -1.9800 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -2.1840 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -4.5110 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -4.3700 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9630 -3.1730 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -4.8800 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1830 -4.3710 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8770 -3.7140 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5220 -5.7110 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0470 -7.6190 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2300 -9.6590 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 -9.8400 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -5.7190 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -6.9590 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 -4.3050 -4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -3.6100 -5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -5.4720 -6.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -6.1550 -6.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1790 -4.5720 -6.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1470 -4.4510 0.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5180 -3.8630 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 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 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 52 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END