NCID-ZINC01699649 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0240 1.0030 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -0.3460 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -0.5380 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -1.6920 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 -2.8540 -0.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -1.3580 -0.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -2.1260 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -0.0540 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 0.9990 -0.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 0.7130 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 1.6500 0.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 3.0920 0.5040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2410 3.3330 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 3.6350 1.9590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7790 3.0640 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 5.0320 1.7840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4740 5.4560 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 4.7940 0.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1260 4.3840 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 3.7540 -0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 6.0140 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 5.6810 -0.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 4.8330 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 5.9190 1.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 5.4270 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 3.7880 2.3220 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0860 -1.6920 0.9440 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 1.5650 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 0.0260 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 6.8480 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 6.3380 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 11 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 10 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 1 26 -1 M END