CHEMBRIDGE-ZINC01123598 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0370 1.3880 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.0020 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -0.6770 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 0.0260 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 1.4290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 2.1020 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 2.1880 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 1.6020 -0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 3.5300 0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 4.2450 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 5.5330 0.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 6.0480 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 5.1530 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 3.5530 0.0280 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -0.6570 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -1.8260 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -2.3250 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -2.5020 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 -3.7140 1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -4.3400 1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 -3.7700 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3680 -2.5690 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -1.9350 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 -1.7980 -0.6380 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 1.9100 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -0.5490 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -1.7570 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 3.1820 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 3.9970 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 7.1090 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1450 5.3710 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -0.2920 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -4.1600 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 -5.2770 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4410 -4.2640 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 -1.0010 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 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 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 36 1 0 0 0 0 M END