PUBCHEM-ZINC03687920 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0550 1.5990 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 0.0780 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -0.4760 1.2450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5610 -0.0180 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -0.1020 2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -1.9850 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -2.8520 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -4.2380 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -4.7390 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -3.9230 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -2.5260 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -4.7730 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -6.0860 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -6.0340 0.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -6.8420 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -7.3590 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -8.3700 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -9.5870 1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 -9.8050 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 -8.8040 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -7.5890 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7350 -9.0920 -1.2730 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 -4.3130 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 -4.4860 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 -4.0330 2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3780 -4.2240 4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 2.0050 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 1.9310 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 2.0290 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -0.2870 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.2960 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 0.9800 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -0.4220 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.5700 3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -2.4520 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -4.8940 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -1.8700 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -8.2160 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -10.3640 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 -10.7550 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -6.8240 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4570 -4.8590 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 -3.2580 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 -3.9090 3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 -5.5370 2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4420 -4.6040 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 -2.9770 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8320 -3.6240 4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 -5.2750 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7890 -3.7740 4.1600 N 0 3 0 0 0 0 0 0 0 0 0 0 9.1850 -3.8810 5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8790 -2.7820 3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3810 -4.3170 3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 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 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 23 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 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50 53 1 0 0 0 0 M CHG 1 50 1 M END