PUBCHEM-ZINC00744471 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 76 0 0 1 0 0 0 0 0999 V2000 1.7830 -2.8830 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -2.4070 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -0.9070 1.5560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4960 -0.7000 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -0.4630 2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -0.1400 1.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7980 -0.4880 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 1.3330 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 2.0930 1.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 1.8060 0.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 3.2530 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 3.6340 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 2.7130 -2.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 1.2660 -2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 0.8850 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 3.1860 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 4.3830 -3.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 2.3310 -3.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 2.8090 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 2.2110 -5.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 2.6850 -6.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 3.7540 -6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 4.3530 -6.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 3.8860 -5.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 5.6950 -7.6680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -0.3690 1.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 -1.0310 1.2410 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0870 -1.0000 2.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -2.2260 0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 0.0630 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 1.0800 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 1.9390 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 1.7810 -1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 0.7640 -2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 -0.0980 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 2.7180 -3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 2.6260 -3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 2.3270 -4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6980 4.1510 -2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -2.2840 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -3.9310 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -2.7730 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -2.9450 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -2.6000 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -0.5920 3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 0.5870 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -1.0660 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 3.5020 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 3.7940 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 4.6560 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 3.5530 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 0.7250 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 1.0170 -2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -0.1360 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 0.9630 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 1.3850 -3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 1.3750 -4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 2.2190 -6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 4.1230 -7.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 4.3570 -5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.1330 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9080 1.2030 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 2.7330 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 0.6400 -3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -0.8950 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9150 1.6050 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9840 3.3040 -3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0660 2.9050 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 2.3920 -4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 3.0040 -5.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7730 1.3050 -4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 4.4300 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 4.8290 -3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6110 4.2160 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 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 22 23 2 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 38 69 1 0 0 0 0 38 70 1 0 0 0 0 38 71 1 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 39 74 1 0 0 0 0 M END