NCID-ZINC04773910 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.2510 1.1440 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -0.2850 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -0.9970 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -2.3080 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -2.8850 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -2.1880 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -0.8860 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -0.1210 -2.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -0.4230 -3.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -1.4410 -3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -1.3400 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -2.2840 -2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 -3.3260 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -3.4230 -4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -2.4890 -4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -2.6340 -5.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -2.7480 -4.9920 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1640 -2.9740 2.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -3.8720 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 -3.1360 3.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2410 -2.3970 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -4.1070 3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -2.1110 1.6090 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -2.8100 3.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -3.8410 3.4330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5400 -4.7960 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -4.0660 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -3.2250 2.3010 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 1.8220 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 1.3360 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 1.3780 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.4740 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -3.9050 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -2.6650 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -0.5070 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -2.1920 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 -4.0540 -3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -4.2240 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -4.6690 3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -4.3950 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -4.8280 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -3.5780 4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -4.6690 4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -2.9660 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -1.7910 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -3.1360 5.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -4.7870 4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 -4.4630 5.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -2.6820 -6.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 49 2 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M CHG 1 17 -1 M END