PUBCHEM-ZINC06404406 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 3.3480 0.9840 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -0.4500 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -1.0800 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -2.3910 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -3.0850 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -2.4430 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 -1.1300 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -3.1840 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -4.3960 0.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -4.9860 1.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -6.2640 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -6.8940 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -8.2640 2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -8.9560 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -8.3220 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -9.0040 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -10.3150 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -10.9490 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -10.2870 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -10.9640 2.2280 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2550 -12.2420 2.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -10.2890 3.3540 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4100 1.0150 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1820 1.4680 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 1.5070 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.5430 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -2.8820 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 -0.6310 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -3.0470 -2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -2.7940 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -4.2460 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -4.8760 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -6.7980 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -6.3370 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -8.7840 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -7.3030 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -8.5230 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -10.8460 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -11.9690 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END