NCID-ZINC05841038 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.4270 1.5410 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 0.2200 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -0.2090 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -1.3960 0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 0.7080 0.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 0.4220 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 2.0190 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 2.8350 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 2.4390 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 3.8730 -0.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7900 4.2910 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 4.6090 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 5.6900 1.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7400 5.5380 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 5.4790 0.2080 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0560 6.1450 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 4.1010 -0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 5.7160 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 5.6300 -0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 6.9960 1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -0.7850 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9720 -1.6760 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -1.1650 1.4490 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5260 -1.8040 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.1290 2.2650 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 0.6270 2.5870 I 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 -0.2010 -0.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -0.8290 -0.8240 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2890 -1.4570 -1.0040 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.4460 1.8860 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 3.9230 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 5.0710 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 4.9610 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 6.7060 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 5.7710 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 7.1600 1.9380 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 30 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 31 1 0 0 0 0 12 32 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 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 27 28 2 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 28 1 M CHG 1 29 -1 M END