NCID-ZINC04962374 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.0170 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 1.4020 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.5620 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 4.1790 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 4.3000 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 6.0880 0.0320 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 6.7930 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 8.3200 0.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8860 8.6570 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 8.9070 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 9.6220 0.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 8.6360 -0.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 9.2060 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7580 8.7540 -2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 8.0290 -2.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 8.7610 1.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 9.9460 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 10.6490 0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 10.3990 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 11.7680 2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 12.2280 3.4530 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8250 11.4640 3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 13.5160 3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 14.5700 3.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.6760 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.5760 -0.0220 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 1.9480 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 4.0350 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 4.0260 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 6.4660 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 6.4570 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 8.0650 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5330 8.8700 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 10.2940 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 8.1990 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 10.4740 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 9.6780 2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 11.6940 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 12.4900 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 13.1470 4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -1.6460 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -0.1870 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0230 9.1550 -2.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 13.4920 2.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 12.4430 4.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 11.5790 4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 14.3430 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4630 8.8390 -3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 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 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 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 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 20 21 1 0 0 0 0 20 41 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 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 46 51 1 0 0 0 0 49 54 1 0 0 0 0 50 53 1 0 0 0 0 51 52 1 0 0 0 0 M END