NCID-ZINC01572158 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 0.4460 1.2500 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.0540 -0.4780 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8810 -0.7640 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -0.6400 0.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4310 -0.3360 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -2.1690 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -2.7220 -0.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.8290 0.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -4.2800 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -4.9420 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -6.4230 1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -6.9990 1.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -8.3740 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -8.8250 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -7.4910 1.8450 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -9.2720 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -10.5720 2.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -11.1890 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -10.3220 1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -8.7050 1.8560 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -12.6410 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -13.2300 2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -13.2560 2.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -14.6870 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -15.0910 2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -16.5960 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -17.0660 2.6560 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 0.2320 -1.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 0.4710 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 1.6750 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 2.0000 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 1.0950 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.3260 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -4.6350 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -4.5160 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -4.5350 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -4.6980 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -9.8410 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -10.5570 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -12.6450 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -15.1530 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -15.0010 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -14.5870 3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -14.7380 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -17.1260 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -16.9720 3.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.1120 -0.7310 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8960 0.1750 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 0.6890 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -0.8830 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 47 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 28 29 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M CHG 1 47 1 M END