PUBCHEM-ZINC05985955 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 0.5750 1.2110 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 0.9300 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 2.9840 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 3.5000 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 4.9270 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 5.9470 -0.6500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0750 5.7920 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 7.1830 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 8.5290 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 8.8300 -1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 9.6270 -2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 9.8870 -3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 9.4190 -4.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 8.6740 -4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 8.3510 -3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 9.3590 0.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 6.9310 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 7.7960 1.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 5.4660 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 4.8950 1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 5.8830 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 6.3840 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 6.2560 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 5.6140 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 5.1080 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 5.2420 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 4.4500 -1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 0.1320 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 1.7530 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 1.5220 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 1.4360 2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.1420 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 1.0880 3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 3.5090 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 3.1110 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 3.3130 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 2.9830 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 10.0270 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 10.4960 -3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 8.3390 -5.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 7.7640 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 7.2510 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 6.8810 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 6.6580 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 5.5170 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 4.8340 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 4.5100 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 1.5060 1.0770 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4010 1.0160 0.7190 H 0 0 0 0 0 0 0 0 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 1 48 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 48 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 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 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 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END