PUBCHEM-ZINC03741324 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -2.6010 1.0350 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 0.1460 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 0.2580 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.5680 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -1.5150 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -1.6360 -1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -0.7780 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -0.8870 -2.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -0.0670 -3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.6660 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -3.0230 -3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -4.0960 -4.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -4.8610 -5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -5.8530 -5.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -6.0960 -5.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -5.3490 -4.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -4.3610 -3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -3.4810 -2.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -3.4240 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -6.8790 -7.3190 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -2.3910 -3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -3.2320 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 -2.4960 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 -3.3230 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 1.8840 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 0.4830 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 1.4250 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 0.9810 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -0.4860 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -2.1730 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -0.1630 -4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 0.9880 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.3950 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -4.6760 -5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -6.8680 -6.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 -5.5300 -4.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -2.2420 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -1.3890 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -3.4790 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -4.1870 -3.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -2.2730 -3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -1.5350 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -3.5250 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 -4.2650 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -2.5640 -2.1350 N 0 3 0 0 0 0 0 0 0 0 0 0 7.9140 -3.0980 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -1.6690 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 -2.3570 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 21 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 M CHG 1 45 1 M END