PUBCHEM-ZINC05973387 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 59 0 0 0 0 0 0 0 0999 V2000 -0.0510 1.5310 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 0.0020 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -0.5310 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -2.0610 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.5940 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -4.1000 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -4.7780 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -6.1590 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -6.8660 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -6.1840 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -4.8020 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -6.9480 -2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 -7.3380 -2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 -8.1140 -4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -8.5050 -4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9710 -9.2810 -5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -8.2250 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -8.8440 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -8.0980 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -8.7300 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -10.1090 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -10.8650 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -10.2400 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -11.0430 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -10.4950 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -10.7720 -0.9410 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1610 -10.1070 -1.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -11.9840 -1.0480 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9690 1.9110 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 1.8780 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 1.8960 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -0.3620 -1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.3450 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 -0.1670 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -0.1850 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -2.4250 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -2.4070 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -2.2290 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -2.2470 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -4.2280 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -6.6880 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -4.2700 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -6.3230 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -7.8480 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -7.9640 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -6.4380 -2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -7.4890 -4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -9.0150 -4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 -9.1300 -3.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5160 -7.6050 -4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0040 -9.5590 -5.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -8.6560 -6.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3610 -10.1810 -5.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -7.0230 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -8.1450 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -11.9400 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -12.3850 -0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -12.8690 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 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 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 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 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 57 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END