PUBCHEM-ZINC05553989 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 71 0 0 1 0 0 0 0 0999 V2000 -0.8510 2.3580 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 0.8710 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 0.1660 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -1.3220 -1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 -2.0260 -0.7400 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3990 -1.5260 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -3.4840 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -4.2340 -0.2800 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6580 -3.6980 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -4.3110 -1.6800 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6220 -4.6740 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 -2.9540 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -1.9640 -1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -5.2620 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 -6.2370 -3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8920 -6.3090 -3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3710 -6.3820 -4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8990 -6.4540 -4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3780 -6.5270 -6.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9060 -6.6000 -6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3840 -6.6730 -7.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9120 -6.7450 -7.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3840 -6.8170 -9.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5800 -6.8110 -9.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.6960 -6.8880 -9.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.0780 -6.9540 -10.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6020 -7.0300 -10.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -5.6250 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -5.9830 0.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 -6.4650 0.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -7.7880 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 -8.5960 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 2.8600 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 2.4750 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 2.8000 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 0.4290 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 0.7550 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 0.6080 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 0.2820 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -1.7640 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -1.4380 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -3.9380 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -3.5270 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -2.7960 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -1.0330 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 -5.1390 -2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -6.9900 -3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 -7.1970 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -5.4200 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 -5.4940 -5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 -7.2700 -5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 -7.3420 -4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3140 -5.5660 -4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0450 -5.6390 -6.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 -7.4160 -6.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2380 -7.4880 -5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3210 -5.7110 -5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0520 -5.7840 -8.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9690 -7.5610 -8.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2440 -7.6330 -7.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3270 -5.8560 -7.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7190 -6.0640 -11.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6360 -7.8410 -11.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9600 -7.9200 -10.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0430 -6.1430 -10.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8880 -7.0800 -11.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -8.2960 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -7.6980 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 -9.5900 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 -8.0890 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2350 -8.6870 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 M END