PUBCHEM-ZINC06196411 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 1.0180 1.5720 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 0.1360 -3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.0500 -2.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -1.3040 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -1.4550 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -2.6910 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -3.8080 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -3.6410 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -2.4000 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -5.1580 -0.3590 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1660 -5.0590 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -6.1870 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -6.2970 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -5.3240 -2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -4.2760 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -3.3080 -3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -3.3780 -2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 -4.4420 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7380 -5.4120 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7930 -4.5480 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7830 -2.4670 -1.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8860 -1.4110 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -7.3350 -3.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -7.1600 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -8.0200 -2.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -6.9060 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -7.6200 0.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -5.7880 0.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -5.3200 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -6.1370 2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -6.3030 5.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -5.9880 6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -6.6280 6.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -6.1780 5.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -6.4990 4.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 1.7690 -4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 1.7810 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 2.2700 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -0.5380 -4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -0.0390 -2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -0.6040 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -2.7740 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -4.4760 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -2.3290 -2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -4.1900 -3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -2.5040 -3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -6.2350 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 -4.6140 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6450 -5.4410 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7440 -3.6760 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7560 -0.8040 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -0.7630 -2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 -1.8000 -3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -7.2290 -3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -5.4370 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -4.2540 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -5.8770 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -7.2170 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -7.3800 5.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -5.7680 5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -4.9080 6.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -6.3610 7.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -5.1030 5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -6.6910 6.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -6.1020 3.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -7.5770 4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -5.8490 4.2240 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1410 -4.8300 4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 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 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 23 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 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 67 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 67 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 67 1 M END