PUBCHEM-ZINC05139771 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.2660 1.7460 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 0.2610 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.4110 0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -1.7720 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -2.6530 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -4.0340 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -4.5850 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -3.7040 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -2.3250 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -4.1230 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -5.4760 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -5.8600 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3290 -7.2850 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5800 -7.5310 -0.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1000 -8.8910 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4700 -9.3400 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -8.2680 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -7.8740 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -6.4580 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -6.0540 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -7.0640 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -7.2430 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -8.1840 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -8.9720 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -8.8160 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -7.8650 1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -7.7900 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -6.6370 3.5950 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6900 2.2600 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.9120 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 2.2050 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -0.1600 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 0.1350 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 0.1450 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -2.2890 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -4.6670 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -1.6830 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7000 -5.1370 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0040 -8.8920 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4160 -9.6000 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9140 -10.3400 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5930 -9.3710 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1960 -8.6540 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 -9.3230 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -8.6440 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -6.6470 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -8.3070 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -9.7130 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -9.4480 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -8.9010 3.7050 O 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 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 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 2 0 0 0 0 M CHG 1 28 -1 M END