IBS-ZINC02213002 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7200 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1000 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.0950 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.7050 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.8120 -2.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -2.1030 -3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -3.1030 -4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -3.3900 -5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -4.3080 -6.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -4.9410 -6.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -4.6570 -6.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -3.7400 -5.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -3.4630 -4.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -5.5210 -6.6610 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -4.6990 -7.3820 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.2030 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6610 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1800 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.7820 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.4900 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -1.4660 -3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -2.8970 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -5.6580 -7.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -2.7350 -4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7420 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 22 1 0 0 0 0 4 30 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 30 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 29 1 0 0 0 0 M END