MAYBRIDGE-ZINC04336854 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3460 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -0.6760 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -1.8930 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 0.0440 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 -0.4090 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 1.3890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 2.0250 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0400 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.5050 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1190 3.8620 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 4.0310 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 4.9140 0.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0150 5.8260 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 5.2350 -0.6180 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8340 6.0560 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 4.0100 -1.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 5.5690 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 5.9730 -2.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 4.1890 0.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -0.9840 0.0130 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 1.8760 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 4.6260 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 3.2030 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 6.3800 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 4.6880 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 6.2000 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 3.8880 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 20 28 1 0 0 0 0 M END