CHEMDIV-ZINC01458585 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.5100 1.5280 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 0.0450 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -0.7310 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -2.1060 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -2.7180 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -1.9470 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.5700 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -4.1810 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -4.7250 1.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.9720 -1.3120 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8020 -5.4130 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -6.8950 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 -7.5090 -2.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -7.3670 -1.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -6.3140 -1.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5460 -6.5260 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -6.3080 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -6.1220 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -6.0990 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -6.2570 -3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -6.4290 -3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -6.4500 -3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -8.7810 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -9.3920 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -10.8830 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -12.8230 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -11.5810 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -4.6930 -1.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 2.0390 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 1.8990 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 1.7860 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -0.2690 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -2.6930 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -2.3810 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 0.0240 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -5.9920 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -5.9540 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -6.2390 -3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -6.5430 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -6.5850 -3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -8.9070 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -9.2960 -2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -9.2160 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -8.8860 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -11.0420 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -11.4400 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -13.5090 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -12.6850 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -13.1810 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -10.5740 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -12.1890 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -12.0450 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -4.3920 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -11.4810 1.1830 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4010 -10.8640 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 28 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 54 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 54 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END