IFLAB-ZINC04497207 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.5740 -0.8570 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.6070 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 0.1620 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -0.4500 -3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.8360 -3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -2.6050 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -1.9920 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -2.4580 -4.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -1.7440 -5.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -2.8200 -6.5640 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0560 -2.6250 -7.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -4.1040 -5.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -3.7840 -4.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -4.6040 -3.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -2.9070 -7.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -3.3720 -8.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -3.7210 -9.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -3.4590 -9.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -3.9100 -10.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -3.8190 -11.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -3.3230 -10.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -3.1130 -9.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -2.9890 -10.1990 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -1.4840 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -1.4890 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -0.2500 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 1.2400 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 0.1480 -3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -3.6830 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -2.5900 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -0.9840 -5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -1.2890 -5.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -4.9510 -6.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 -4.3100 -5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -2.6290 -7.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -4.2660 -11.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -4.0940 -12.2040 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 M END