PUBCHEM-ZINC05966654 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 0.0350 1.4900 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 1.2110 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.5530 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 1.0770 3.6340 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9230 1.6660 4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 1.4170 4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 1.9730 3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 1.4290 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 1.6690 2.3740 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7660 2.7630 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 1.1300 1.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6170 1.5880 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -0.4150 1.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3270 -0.6230 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -1.1510 2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -0.4630 3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -1.2270 4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -2.6270 4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -3.2910 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -2.5590 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -3.2130 5.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -4.6330 6.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -0.9300 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 0.4880 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 2.2320 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 1.6790 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 1.7450 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 0.1400 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 1.1300 4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 2.6430 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 1.2970 5.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 2.7540 4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 0.3440 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 1.8930 5.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 1.7230 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 3.0680 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 0.3630 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8590 1.9180 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -0.7460 5.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -4.3740 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -3.1050 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -4.9330 7.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -4.9890 5.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -5.0940 5.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -1.6600 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.6610 1.1760 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8370 2.6820 1.2650 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 46 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 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 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 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 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 46 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END