IBS-ZINC01894123 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 0.0100 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 1.2240 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.0430 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4220 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 2.4060 -0.0230 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -2.1550 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -2.7810 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -2.8830 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -4.3280 -0.0420 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2160 -4.9520 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -6.3140 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -7.0290 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -6.3260 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -4.9650 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -8.4900 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -9.0840 -1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -9.1610 1.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -10.6060 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -11.1160 2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -12.6260 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -13.1020 3.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9010 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 -0.4750 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 -2.6040 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -2.6130 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -4.3910 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -6.8190 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -6.8410 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -4.4140 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -8.6870 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -10.8160 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -11.1080 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -10.9070 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -10.6150 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -12.8360 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -13.1280 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -14.0540 3.9580 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 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 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 11 1 M END