NCID-ZINC01701357 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 1 0 0 0 0 0999 V2000 0.0190 1.4180 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.0150 -0.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -0.7290 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -2.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -3.1880 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -4.3810 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -4.1010 0.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -2.7450 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -2.1240 -0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -0.7980 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -0.0780 -0.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 -5.0790 0.2780 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2810 -4.6040 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -5.7510 1.6640 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4690 -6.0600 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -7.0240 1.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2840 -6.8400 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -7.3950 -0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2820 -7.8270 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -6.1560 -0.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 -8.3460 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -8.6350 -1.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -7.7700 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -8.0130 2.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -7.4800 3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -5.0680 2.4990 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6130 -2.9930 0.2260 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 1.7930 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 1.7320 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.8880 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -0.5180 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -5.3980 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -0.2320 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -7.9000 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -9.2950 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 8 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 33 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 34 1 0 0 0 0 21 35 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