IFLAB-ZINC04939721 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -0.0200 1.4160 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.0120 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -0.6090 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.1320 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -2.7700 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -4.8820 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4390 -4.2830 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -6.2760 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -6.1510 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -5.0550 -2.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -7.2580 -2.8140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 -7.1420 -4.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -6.0100 -4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -5.8980 -6.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -6.9120 -6.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -8.0400 -6.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -8.1560 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -9.6960 -3.9330 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.2430 -5.0010 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -4.5880 2.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.7910 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.7790 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.7680 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -0.2980 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2880 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -2.4420 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -2.4530 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -2.4600 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 -2.4500 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 -6.8450 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 -6.7910 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 -8.1350 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -5.2180 -4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -5.0170 -6.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -6.8220 -7.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -8.8310 -6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -4.2340 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -4.5410 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4370 -5.5650 1.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 -5.6190 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 6 37 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 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 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 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 19 20 2 0 0 0 0 19 39 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 M END