PUBCHEM-ZINC03688457 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.2310 1.5430 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 0.0290 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -0.4730 -1.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -1.8340 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -2.7640 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -4.1350 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.5920 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -3.6780 -2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.2970 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -1.3760 -3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -0.5100 -3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 0.1480 -4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 1.1140 -5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 1.5520 -6.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 1.0530 -7.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 0.0960 -6.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -0.3370 -5.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -1.2490 -4.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.7570 -4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -0.5740 -7.7860 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 2.7340 -6.9720 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -0.3080 -2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 -1.3660 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 -1.1620 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0560 -2.2410 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.9500 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 1.8520 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 1.9840 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -0.2510 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.3520 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -2.4560 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -4.8480 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -5.6600 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -4.0470 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 1.5140 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 1.4110 -8.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 0.6920 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 -0.3350 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 -2.3680 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -1.3260 -2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4570 -0.1720 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -1.1840 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -3.2400 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7260 -2.2220 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8940 -2.0060 0.5480 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6200 -2.7290 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3390 -2.0250 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 -1.0970 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 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 22 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 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