NCID-ZINC05841029 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.4360 1.5020 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 0.1910 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.1970 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -1.3730 0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 0.7490 0.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 0.4920 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 2.0500 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 2.8910 0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 2.4310 -0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 3.8530 -0.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6400 4.4120 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 4.4130 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 4.3090 -2.5670 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1160 3.6520 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 3.6990 -1.7240 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5410 2.6170 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 4.0370 -0.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 4.3170 -2.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 3.6590 -1.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 5.6040 -3.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -0.8460 -0.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8760 -1.7360 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -1.2150 1.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4820 -1.8800 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -2.1240 2.2540 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 0.5810 2.4790 I 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -0.3060 -0.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -0.9630 -0.9460 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1820 -1.6200 -1.1410 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.4630 1.8160 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 5.4520 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 3.8070 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 5.3770 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 4.1980 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 4.0000 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 6.0560 -3.5340 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