PUBCHEM-ZINC04157658 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 0.0330 1.1910 -1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -0.2780 -1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -1.0010 -2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.3700 -2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -2.9680 -2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -2.2540 -1.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -0.9180 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.4770 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -1.4880 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -2.6000 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 -3.9700 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2550 -4.7250 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 -4.2040 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -5.6160 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -6.3620 0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -6.0500 2.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -7.4230 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -7.6530 4.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7030 -7.3940 5.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 -7.6050 6.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -8.0760 7.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 -8.3360 6.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -8.1290 5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -8.8480 7.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -8.9790 8.9860 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -10.0940 7.1700 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -7.9470 7.5880 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 -4.0660 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -3.2850 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -3.3730 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7070 -4.2410 -1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -5.0200 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -4.9300 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8250 -5.9670 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1370 -5.8790 -4.0290 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -5.6240 -4.5730 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 -7.2760 -3.1280 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 1.4980 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 1.7620 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 1.3740 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -0.5250 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -2.9470 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -4.0210 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -1.4250 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -4.0470 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -3.5050 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 -5.4530 3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -7.5800 2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -8.1220 2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5230 -7.0260 4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8320 -7.4020 7.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -8.2400 8.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -8.3350 5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -2.6070 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3730 -2.7640 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6620 -4.3100 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -5.5360 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 M END