IBS-ZINC01799019 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 0.1300 1.3140 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.2160 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -0.6630 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -1.9950 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -2.7610 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.5190 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -2.8360 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 -2.7560 2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 -3.1410 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -3.6060 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9070 -3.6870 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 -3.3030 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -3.2770 -0.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -2.8160 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -2.6540 -2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -2.9880 -3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -2.8340 -4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -2.3510 -5.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -2.0180 -4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -2.1610 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 -4.1300 4.1550 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 -3.0670 4.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -4.2020 5.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -5.2060 4.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -4.2270 6.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -5.4020 7.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -5.4180 8.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -4.2740 9.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 -3.1060 8.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -3.0740 7.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 1.6500 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.6890 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 1.6930 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -0.5940 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.5910 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -2.3960 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8550 -4.0490 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1710 -3.3660 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -3.0930 -5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -2.2330 -6.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -1.6410 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -1.8960 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 -6.2960 6.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -6.3260 9.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -4.2920 10.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -2.2160 9.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 -2.1600 7.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END