IFLAB-ZINC04340710 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.2680 1.5890 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 0.0840 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.7160 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -0.1140 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -0.8930 3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.2680 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -2.8710 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.1060 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -2.6850 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.0640 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -2.7020 -2.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.5940 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 0.1230 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -0.0380 -3.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 0.6320 -4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 1.4630 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.6270 -4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 0.9570 -2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 2.3790 -6.5330 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.3150 4.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 0.1750 5.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.0020 4.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 0.9440 6.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 1.3870 6.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 0.0510 7.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 1.9000 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 2.0050 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 1.9500 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 0.9520 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -2.8690 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -3.9380 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -0.6860 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 0.5080 -5.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 2.2770 -4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 1.0820 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 1.8220 6.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 0.5090 6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 1.9440 7.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 2.0230 5.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 0.6080 8.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -0.8260 7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -0.2640 7.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END