PUBCHEM-ZINC05696708 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.4180 1.5660 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 0.0400 -0.6410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7500 -0.4020 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -0.4060 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 0.2160 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -0.2420 2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 0.2040 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -0.4170 -0.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0870 -1.5040 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -0.8730 -1.6670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4380 -1.1880 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -2.0980 -2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -1.9780 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -2.7480 -4.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4040 -0.8860 -3.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -0.1890 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 0.8280 -2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3700 -0.5020 -4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7180 -0.5580 -4.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6680 -0.1790 -5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 0.2560 -6.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9320 0.3120 -6.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 -0.0600 -5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5780 0.7720 -7.6420 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 1.8920 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 1.8840 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 2.0080 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -1.4930 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -0.0800 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -0.1020 2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 1.3020 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -1.3290 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 0.2010 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -0.1220 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 1.2910 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -2.0500 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 -3.0220 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0240 -0.8970 -3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7170 -0.2220 -4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 0.6520 -7.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -0.0120 -6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 0.0120 -1.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 0.9720 -1.4060 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 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 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 10 42 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 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 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 42 43 1 0 0 0 0 M END