PUBCHEM-ZINC03872464 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 70 0 0 1 0 0 0 0 0999 V2000 1.6870 -0.7370 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -0.0440 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 1.3960 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.7970 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -2.1900 0.7100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0270 -2.7150 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -2.9780 -0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9180 -2.4530 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -4.3500 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -5.3320 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -4.4850 1.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -5.8180 2.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0700 -6.5270 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -6.2530 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -6.4590 1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -5.1720 3.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -5.7820 3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 -4.7180 3.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -6.9310 3.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 -6.9030 4.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4370 -6.0040 5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8010 -6.8980 4.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9100 -5.5960 3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8180 -8.0870 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 -8.1210 5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 -9.0370 5.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -8.1940 6.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -9.4210 7.5960 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2860 -9.8750 7.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7030 -9.0850 9.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6540 -8.2180 9.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -7.9020 9.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2630 -10.3850 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -10.0790 5.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -3.1010 -1.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -0.2000 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -1.7630 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -0.7400 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.0400 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 1.9560 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 1.3960 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.8630 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -0.2470 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -0.8910 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -3.6990 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -7.1880 3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -5.5010 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -6.8770 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -7.1440 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -5.0250 4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -5.4810 4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -4.2370 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -7.7770 3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -6.9760 4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 -5.5180 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8420 -5.5920 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8980 -4.7490 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 -9.0160 3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7110 -8.0380 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 -8.0540 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7860 -7.4330 7.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6530 -8.5510 9.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8160 -10.0060 9.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -3.5590 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -1.6080 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 -7.7980 10.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4640 -11.5850 7.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.0630 2.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -1.5740 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1070 -12.1690 7.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1160 -7.2440 11.3100 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 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 68 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 33 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 31 66 1 0 0 0 0 33 34 2 0 0 0 0 33 67 1 0 0 0 0 35 64 1 0 0 0 0 65 68 1 0 0 0 0 66 71 1 0 0 0 0 67 70 1 0 0 0 0 68 69 1 0 0 0 0 M END