PUBCHEM-ZINC02976076 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 59 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 0.5490 -1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -0.5470 -2.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -0.1270 -3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -0.6780 -4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -1.3570 -4.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -0.3920 -6.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -0.9010 -7.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -0.6290 -8.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 0.1480 -8.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 0.6560 -7.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 0.3870 -6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 0.5170 -10.4430 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 0.0340 1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 0.8310 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.5500 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -1.5490 2.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 0.0230 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -0.5800 4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -0.0390 5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 1.0980 5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 1.7000 4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 1.1730 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 1.6820 6.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 2.0680 7.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6710 2.9250 6.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8840 0.6450 7.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -0.5020 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 0.9610 -3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -1.5060 -7.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -1.0220 -9.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 1.2620 -7.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 0.7800 -5.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -1.4670 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -0.5050 6.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 2.5870 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 1.6470 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 2.8070 7.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 2.4910 8.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 1.1820 8.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 2.6500 5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 3.3480 7.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 3.6630 6.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 -0.2410 7.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4210 1.0680 8.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5940 0.3700 6.6190 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 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 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 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END